(4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

C97H161N5O67 — CID 122659068

About (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

(4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid (PubChem CID 122659068) has the molecular formula C97H161N5O67 and a molecular weight of 2469.32 g/mol. Its IUPAC name is (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid.

Molecular Properties

• Compound Name: (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
• PubChem CID: 122659068
• Molecular Formula: C97H161N5O67
• Molecular Weight: 2469.32 g/mol
• Exact Mass: 2467.93
• IUPAC Name: (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
• SMILES: CC(=O)N[C@@H]1C(C)OC(COC2O[C@@H](C)[C@@H](O)C(O)C2O)[C@@H](OC2OC(CO)[C@@H](OC3OC(COC4OC(CO)[C@@H](O)[C@H](O)[C@H]4OC4OC(CO)[C@@H](OC5OC(COC6(C(=O)O)C[C@@H](O)[C@@H](C)C([C@@H](O)[C@H](O)CO)O6)[C@H](O)[C@H](O)[C@@H]5O)[C@H](O)[C@@H]4NC(C)=O)[C@@H](OC4OC(CO)[C@@H](O)[C@H](O)[C@@H]4NC(C)=O)[C@H](O[C@@H]4OC(CO)C(O)[C@H](O)[C@@H]4OC4OC(CO)[C@@H](OC5CC(O)[C@@H](O)C(COC6(C(=O)O)C[C@@H](O)[C@@H](C)C([C@@H](O)[C@H](O)CO)O6)O5)[C@H](O)[C@@H]4NC(C)=O)[C@H]3O)[C@H](O)[C@@H]2NC(C)=O)[C@@H]1O
• InChI: InChI=1S/C97H161N5O67/c1-25-35(117)11-96(94(141)142,168-75(25)57(123)37(119)13-103)147-23-45-56(122)34(116)10-49(151-45)160-77-42(18-108)155-88(52(65(77)131)100-31(7)113)167-84-71(137)61(127)41(17-107)154-93(84)165-82-74(140)91(163-79-44(20-110)156-86(53(66(79)132)101-32(8)114)161-80-47(149-27(3)50(64(80)130)98-29(5)111)21-145-89-72(138)68(134)55(121)28(4)150-89)159-48(81(82)164-85-51(99-30(6)112)63(129)59(125)39(15-105)152-85)22-146-92-83(70(136)60(126)40(16-106)153-92)166-87-54(102-33(9)115)67(133)78(43(19-109)157-87)162-90-73(139)69(135)62(128)46(158-90)24-148-97(95(143)144)12-36(118)26(2)76(169-97)58(124)38(120)14-104/h25-28,34-93,103-110,116-140H,10-24H2,1-9H3,(H,98,111)(H,99,112)(H,100,113)(H,101,114)(H,102,115)(H,141,142)(H,143,144)/t25-,26-,27?,28+,34?,35-,36-,37-,38-,39?,40?,41?,42?,43?,44?,45?,46?,47?,48?,49?,50-,51+,52+,53+,54+,55-,56-,57+,58+,59-,60-,61?,62+,63-,64-,65-,66-,67-,68?,69+,70+,71+,72?,73+,74-,75?,76?,77-,78-,79-,80-,81-,82-,83-,84+,85?,86?,87?,88?,89?,90?,91?,92?,93+,96?,97?/m1/s1
• InChIKey: FVYVBCHDXSHBTL-ZQTGIJSLSA-N
• XLogP: -24.52
• TPSA: 1118.44 Ų
• H-Bond Donors: 40
• H-Bond Acceptors: 65
• Rotatable Bonds: 47
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2469.32
LogP ≤ 5	-24.52
H-Bond Donors ≤ 5	40
H-Bond Acceptors ≤ 10	65

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid?

The IUPAC name of (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid (CID 122659068) is (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid.

What is the SMILES notation for (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid?

The canonical SMILES for (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid is CC(=O)N[C@@H]1C(C)OC(COC2O[C@@H](C)[C@@H](O)C(O)C2O)[C@@H](OC2OC(CO)[C@@H](OC3OC(COC4OC(CO)[C@@H](O)[C@H](O)[C@H]4OC4OC(CO)[C@@H](OC5OC(COC6(C(=O)O)C[C@@H](O)[C@@H](C)C([C@@H](O)[C@H](O)CO)O6)[C@H](O)[C@H](O)[C@@H]5O)[C@H](O)[C@@H]4NC(C)=O)[C@@H](OC4OC(CO)[C@@H](O)[C@H](O)[C@@H]4NC(C)=O)[C@H](O[C@@H]4OC(CO)C(O)[C@H](O)[C@@H]4OC4OC(CO)[C@@H](OC5CC(O)[C@@H](O)C(COC6(C(=O)O)C[C@@H](O)[C@@H](C)C([C@@H](O)[C@H](O)CO)O6)O5)[C@H](O)[C@@H]4NC(C)=O)[C@H]3O)[C@H](O)[C@@H]2NC(C)=O)[C@@H]1O.

What is the InChIKey of (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid?

The InChIKey is FVYVBCHDXSHBTL-ZQTGIJSLSA-N. The full InChI is InChI=1S/C97H161N5O67/c1-25-35(117)11-96(94(141)142,168-75(25)57(123)37(119)13-103)147-23-45-56(122)34(116)10-49(151-45)160-77-42(18-108)155-88(52(65(77)131)100-31(7)113)167-84-71(137)61(127)41(17-107)154-93(84)165-82-74(140)91(163-79-44(20-110)156-86(53(66(79)132)101-32(8)114)161-80-47(149-27(3)50(64(80)130)98-29(5)111)21-145-89-72(138)68(134)55(121)28(4)150-89)159-48(81(82)164-85-51(99-30(6)112)63(129)59(125)39(15-105)152-85)22-146-92-83(70(136)60(126)40(16-106)153-92)166-87-54(102-33(9)115)67(133)78(43(19-109)157-87)162-90-73(139)69(135)62(128)46(158-90)24-148-97(95(143)144)12-36(118)26(2)76(169-97)58(124)38(120)14-104/h25-28,34-93,103-110,116-140H,10-24H2,1-9H3,(H,98,111)(H,99,112)(H,100,113)(H,101,114)(H,102,115)(H,141,142)(H,143,144)/t25-,26-,27?,28+,34?,35-,36-,37-,38-,39?,40?,41?,42?,43?,44?,45?,46?,47?,48?,49?,50-,51+,52+,53+,54+,55-,56-,57+,58+,59-,60-,61?,62+,63-,64-,65-,66-,67-,68?,69+,70+,71+,72?,73+,74-,75?,76?,77-,78-,79-,80-,81-,82-,83-,84+,85?,86?,87?,88?,89?,90?,91?,92?,93+,96?,97?/m1/s1.

What are the key properties of (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid?

(4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid has a molecular weight of 2469.32 g/mol, XLogP of -24.52, 47 rotatable bonds, 40 hydrogen bond donors, and 65 hydrogen bond acceptors.

Where does this data come from?

All data for (4R,5R)-2-[[(3R,4R)-6-[(3S,4R,5S)-5-acetamido-6-[(2S,3S,4S)-2-[(3R,4R,5R)-2-[(3S,4R,5S)-5-acetamido-6-[(3S,4R,5S)-5-acetamido-4-hydroxy-6-methyl-2-[[(5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-[[(3R,4S,5S)-3-[(3S,4R,5S)-3-acetamido-5-[(3S,4S,5R)-6-[[(4R,5R)-2-carboxy-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5-[(3S,4R,5S)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-5-methyl-6-[(1S,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid is sourced from PubChem (CID 122659068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).