(2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate

C249H341N49O90S5 — CID 161251433

About (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate

(2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate (PubChem CID 161251433) has the molecular formula C249H341N49O90S5 and a molecular weight of 5621.06 g/mol. Its IUPAC name is (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate.

Molecular Properties

• Compound Name: (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate
• PubChem CID: 161251433
• Molecular Formula: C249H341N49O90S5
• Molecular Weight: 5621.06 g/mol
• Exact Mass: 5617.22
• IUPAC Name: (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate
• SMILES: C=C1C[C@@H](C2OCCN2C(=O)OCCSSC[C@@H](NC(=O)[C@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CC(=O)[C@@H](CCC(=O)O)NC(=O)C(CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CC(=O)[C@@H](CCC(=O)O)NC(=O)C(CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CC(=O)CC[C@H](NC(=O)c2ccc(NCc3cnc4nc(N)[nH]c(=O)c4n3)cc2)C(=O)O)C(=O)O)N(C(=O)c2cc(OC)c(OCCCC(=O)Nc3cc(C(=O)Nc4cc(C(=O)Cc5cc(C(=O)Nc6cc(C(=O)CCCCN(C)C)n(C)c6)n(C)c5)n(C)c4)n(C)c3)cc2N)C1.C=C1C[C@@H](C2OCCN2C(=O)OCCSSc2ccccn2)N(C(=O)c2cc(OC)c(OCCCC(=O)Nc3cc(C(=O)Nc4cc(C(=O)Cc5cc(C(=O)Nc6cc(C(=O)CCCCN(C)C)n(C)c6)n(C)c5)n(C)c4)n(C)c3)cc2N)C1.Nc1nc2ncc(CNc3ccc(C(=O)N[C@@H](CCC(=O)C[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@H](CCC(=O)O)C(=O)C[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@H](CCC(=O)O)C(=O)C[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@H](CS)C(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1
• InChI: InChI=1S/C122H168N24O45S2.C68H101N13O34S.C59H72N12O11S2/c1-61-36-83(146(52-61)117(182)73-45-94(188-8)95(46-74(73)123)189-32-11-13-99(164)130-68-44-82(144(7)54-68)115(180)133-70-43-80(143(6)56-70)87(154)38-62-37-81(141(4)53-62)114(179)132-69-42-79(142(5)55-69)84(151)12-9-10-30-140(2)3)118-145(31-33-190-118)122(187)191-34-35-192-193-60-78(120(185)186)137-113(178)66(18-27-98(163)128-51-90(157)105(171)108(174)93(160)59-149)41-86(153)76(24-29-101(167)168)135-112(177)65(17-26-97(162)127-50-89(156)104(170)107(173)92(159)58-148)40-85(152)75(23-28-100(165)166)134-111(176)64(16-25-96(161)126-49-88(155)103(169)106(172)91(158)57-147)39-72(150)21-22-77(119(183)184)136-110(175)63-14-19-67(20-15-63)125-47-71-48-129-109-102(131-71)116(181)139-121(124)138-109;69-68-80-60-53(65(111)81-68)75-34(21-74-60)20-70-33-6-1-29(2-7-33)61(107)78-38(66(112)113)9-8-35(85)17-30(3-12-48(94)71-22-42(88)54(101)57(104)45(91)25-82)62(108)76-36(10-15-51(97)98)40(86)18-31(4-13-49(95)72-23-43(89)55(102)58(105)46(92)26-83)63(109)77-37(11-16-52(99)100)41(87)19-32(64(110)79-39(28-116)67(114)115)5-14-50(96)73-24-44(90)56(103)59(106)47(93)27-84;1-37-24-48(58-70(19-21-81-58)59(78)82-22-23-83-84-54-16-9-11-17-61-54)71(32-37)57(77)42-30-51(79-8)52(31-43(42)60)80-20-13-15-53(74)62-39-29-47(69(7)34-39)56(76)64-41-28-45(68(6)36-41)50(73)26-38-25-46(66(4)33-38)55(75)63-40-27-44(67(5)35-40)49(72)14-10-12-18-65(2)3/h14-15,19-20,37,42-46,48,53-56,64-66,75-78,83,88-93,103-108,118,125,147-149,155-160,169-174H,1,9-13,16-18,21-36,38-41,47,49-52,57-60,123H2,2-8H3,(H,126,161)(H,127,162)(H,128,163)(H,130,164)(H,132,179)(H,133,180)(H,134,176)(H,135,177)(H,136,175)(H,137,178)(H,165,166)(H,167,168)(H,183,184)(H,185,186)(H3,124,129,138,139,181);1-2,6-7,21,30-32,36-39,42-47,54-59,70,82-84,88-93,101-106,116H,3-5,8-20,22-28H2,(H,71,94)(H,72,95)(H,73,96)(H,76,108)(H,77,109)(H,78,107)(H,79,110)(H,97,98)(H,99,100)(H,112,113)(H,114,115)(H3,69,74,80,81,111);9,11,16-17,25,27-31,33-36,48,58H,1,10,12-15,18-24,26,32,60H2,2-8H3,(H,62,74)(H,63,75)(H,64,76)/t64?,65?,66-,75-,76-,77+,78-,83+,88+,89+,90+,91-,92-,93-,103-,104-,105-,106-,107-,108-,118?;30-,31-,32-,36-,37-,38+,39-,42+,43+,44+,45-,46-,47-,54-,55-,56-,57-,58-,59-;48-,58?/m110/s1
• InChIKey: VBICCBCXHZFSGR-UTYAQHADSA-N
• XLogP: -8.44
• TPSA: 2143.09 Ų
• H-Bond Donors: 67
• H-Bond Acceptors: 110
• Rotatable Bonds: 170
• Heavy Atoms: 393
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5621.06
LogP ≤ 5	-8.44
H-Bond Donors ≤ 5	67
H-Bond Acceptors ≤ 10	110

Frequently Asked Questions

What is the IUPAC name of (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate?

The IUPAC name of (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate (CID 161251433) is (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate.

What is the SMILES notation for (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate?

The canonical SMILES for (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate is C=C1C[C@@H](C2OCCN2C(=O)OCCSSC[C@@H](NC(=O)[C@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CC(=O)[C@@H](CCC(=O)O)NC(=O)C(CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CC(=O)[C@@H](CCC(=O)O)NC(=O)C(CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CC(=O)CC[C@H](NC(=O)c2ccc(NCc3cnc4nc(N)[nH]c(=O)c4n3)cc2)C(=O)O)C(=O)O)N(C(=O)c2cc(OC)c(OCCCC(=O)Nc3cc(C(=O)Nc4cc(C(=O)Cc5cc(C(=O)Nc6cc(C(=O)CCCCN(C)C)n(C)c6)n(C)c5)n(C)c4)n(C)c3)cc2N)C1.C=C1C[C@@H](C2OCCN2C(=O)OCCSSc2ccccn2)N(C(=O)c2cc(OC)c(OCCCC(=O)Nc3cc(C(=O)Nc4cc(C(=O)Cc5cc(C(=O)Nc6cc(C(=O)CCCCN(C)C)n(C)c6)n(C)c5)n(C)c4)n(C)c3)cc2N)C1.Nc1nc2ncc(CNc3ccc(C(=O)N[C@@H](CCC(=O)C[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@H](CCC(=O)O)C(=O)C[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@H](CCC(=O)O)C(=O)C[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@H](CS)C(=O)O)C(=O)O)cc3)nc2c(=O)[nH]1.

What is the InChIKey of (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate?

The InChIKey is VBICCBCXHZFSGR-UTYAQHADSA-N. The full InChI is InChI=1S/C122H168N24O45S2.C68H101N13O34S.C59H72N12O11S2/c1-61-36-83(146(52-61)117(182)73-45-94(188-8)95(46-74(73)123)189-32-11-13-99(164)130-68-44-82(144(7)54-68)115(180)133-70-43-80(143(6)56-70)87(154)38-62-37-81(141(4)53-62)114(179)132-69-42-79(142(5)55-69)84(151)12-9-10-30-140(2)3)118-145(31-33-190-118)122(187)191-34-35-192-193-60-78(120(185)186)137-113(178)66(18-27-98(163)128-51-90(157)105(171)108(174)93(160)59-149)41-86(153)76(24-29-101(167)168)135-112(177)65(17-26-97(162)127-50-89(156)104(170)107(173)92(159)58-148)40-85(152)75(23-28-100(165)166)134-111(176)64(16-25-96(161)126-49-88(155)103(169)106(172)91(158)57-147)39-72(150)21-22-77(119(183)184)136-110(175)63-14-19-67(20-15-63)125-47-71-48-129-109-102(131-71)116(181)139-121(124)138-109;69-68-80-60-53(65(111)81-68)75-34(21-74-60)20-70-33-6-1-29(2-7-33)61(107)78-38(66(112)113)9-8-35(85)17-30(3-12-48(94)71-22-42(88)54(101)57(104)45(91)25-82)62(108)76-36(10-15-51(97)98)40(86)18-31(4-13-49(95)72-23-43(89)55(102)58(105)46(92)26-83)63(109)77-37(11-16-52(99)100)41(87)19-32(64(110)79-39(28-116)67(114)115)5-14-50(96)73-24-44(90)56(103)59(106)47(93)27-84;1-37-24-48(58-70(19-21-81-58)59(78)82-22-23-83-84-54-16-9-11-17-61-54)71(32-37)57(77)42-30-51(79-8)52(31-43(42)60)80-20-13-15-53(74)62-39-29-47(69(7)34-39)56(76)64-41-28-45(68(6)36-41)50(73)26-38-25-46(66(4)33-38)55(75)63-40-27-44(67(5)35-40)49(72)14-10-12-18-65(2)3/h14-15,19-20,37,42-46,48,53-56,64-66,75-78,83,88-93,103-108,118,125,147-149,155-160,169-174H,1,9-13,16-18,21-36,38-41,47,49-52,57-60,123H2,2-8H3,(H,126,161)(H,127,162)(H,128,163)(H,130,164)(H,132,179)(H,133,180)(H,134,176)(H,135,177)(H,136,175)(H,137,178)(H,165,166)(H,167,168)(H,183,184)(H,185,186)(H3,124,129,138,139,181);1-2,6-7,21,30-32,36-39,42-47,54-59,70,82-84,88-93,101-106,116H,3-5,8-20,22-28H2,(H,71,94)(H,72,95)(H,73,96)(H,76,108)(H,77,109)(H,78,107)(H,79,110)(H,97,98)(H,99,100)(H,112,113)(H,114,115)(H3,69,74,80,81,111);9,11,16-17,25,27-31,33-36,48,58H,1,10,12-15,18-24,26,32,60H2,2-8H3,(H,62,74)(H,63,75)(H,64,76)/t64?,65?,66-,75-,76-,77+,78-,83+,88+,89+,90+,91-,92-,93-,103-,104-,105-,106-,107-,108-,118?;30-,31-,32-,36-,37-,38+,39-,42+,43+,44+,45-,46-,47-,54-,55-,56-,57-,58-,59-;48-,58?/m110/s1.

What are the key properties of (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate?

(2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate has a molecular weight of 5621.06 g/mol, XLogP of -8.44, 170 rotatable bonds, 67 hydrogen bond donors, and 110 hydrogen bond acceptors.

Where does this data come from?

All data for (2S,7R)-7-[[(3R,6R)-6-[[(3R,6R)-6-[[(1S)-2-[2-[2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carbonyl]oxyethyldisulfanyl]-1-carboxyethyl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-1-carboxy-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;(2S,7R)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-7-[[(3R,6R)-1-carboxy-6-[[(3R,6R)-1-carboxy-6-[[(1S)-1-carboxy-2-sulfanylethyl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-4,9-dioxo-9-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]nonan-3-yl]carbamoyl]-5,10-dioxo-10-[[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]amino]decanoic acid;2-(pyridin-2-yldisulfanyl)ethyl 2-[(2S)-1-[2-amino-4-[4-[[5-[[5-[2-[5-[[5-[5-(dimethylamino)pentanoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]acetyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]amino]-4-oxobutoxy]-5-methoxybenzoyl]-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine-3-carboxylate is sourced from PubChem (CID 161251433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).