(2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid

C74H137N4O72P5 — CID 171125863

About (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid

(2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid (PubChem CID 171125863) has the molecular formula C74H137N4O72P5 and a molecular weight of 2389.74 g/mol. Its IUPAC name is (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid.

Molecular Properties

• Compound Name: (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid
• PubChem CID: 171125863
• Molecular Formula: C74H137N4O72P5
• Molecular Weight: 2389.74 g/mol
• Exact Mass: 2388.59
• IUPAC Name: (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid
• SMILES: NCCOP(=O)(O)OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](OC[C@H]3O[C@@H](O[C@H]4[C@H](O[C@H]5O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](OP(=O)(O)OCCN)C5O[C@H]5O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@H](O)[C@@H](O[C@H]5[C@@H]([C@H](O)CO)O[C@@](O)(C(=O)O)C[C@H]5OP(=O)(O)OP(=O)(O)OCCN)O[C@@H]4[C@H](CO)O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2[C@H](CO)O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)C(O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](OP(=O)(O)OCCN)[C@@H]1O
• InChI: InChI=1S/C74H137N4O72P5/c75-1-5-124-151(113,114)128-19-30-34(93)58(148-152(115,116)125-6-2-76)49(108)70(135-30)142-59-41(100)46(105)64(139-56(59)27(16-85)132-66-47(106)40(99)54(26(15-84)131-66)138-67-43(102)36(95)32(91)25(14-83)130-67)123-18-29-33(92)37(96)44(103)68(134-29)144-62-57(28(17-86)133-65-42(101)35(94)31(90)24(13-82)129-65)141-71(140-55-23(147-155(121,122)150-154(119,120)127-8-4-78)9-74(112,73(110)111)146-53(55)22(89)12-81)50(109)60(62)143-72-63(145-69-45(104)38(97)39(98)51(136-69)20(87)10-79)61(149-153(117,118)126-7-3-77)48(107)52(137-72)21(88)11-80/h20-72,79-109,112H,1-19,75-78H2,(H,110,111)(H,113,114)(H,115,116)(H,117,118)(H,119,120)(H,121,122)/t20-,21-,22+,23+,24+,25+,26+,27-,28-,29+,30+,31+,32?,33+,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+,74+/m0/s1
• InChIKey: JFXGPBKWEVYNCZ-CATWKHHCSA-N
• XLogP: -25.00
• TPSA: 1233.68 Ų
• H-Bond Donors: 42
• H-Bond Acceptors: 70
• Rotatable Bonds: 56
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2389.74
LogP ≤ 5	-25.00
H-Bond Donors ≤ 5	42
H-Bond Acceptors ≤ 10	70

Frequently Asked Questions

What is the IUPAC name of (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid?

The IUPAC name of (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid (CID 171125863) is (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid.

What is the SMILES notation for (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid?

The canonical SMILES for (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid is NCCOP(=O)(O)OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](OC[C@H]3O[C@@H](O[C@H]4[C@H](O[C@H]5O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](OP(=O)(O)OCCN)C5O[C@H]5O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@H](O)[C@@H](O[C@H]5[C@@H]([C@H](O)CO)O[C@@](O)(C(=O)O)C[C@H]5OP(=O)(O)OP(=O)(O)OCCN)O[C@@H]4[C@H](CO)O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2[C@H](CO)O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)C(O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](OP(=O)(O)OCCN)[C@@H]1O.

What is the InChIKey of (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid?

The InChIKey is JFXGPBKWEVYNCZ-CATWKHHCSA-N. The full InChI is InChI=1S/C74H137N4O72P5/c75-1-5-124-151(113,114)128-19-30-34(93)58(148-152(115,116)125-6-2-76)49(108)70(135-30)142-59-41(100)46(105)64(139-56(59)27(16-85)132-66-47(106)40(99)54(26(15-84)131-66)138-67-43(102)36(95)32(91)25(14-83)130-67)123-18-29-33(92)37(96)44(103)68(134-29)144-62-57(28(17-86)133-65-42(101)35(94)31(90)24(13-82)129-65)141-71(140-55-23(147-155(121,122)150-154(119,120)127-8-4-78)9-74(112,73(110)111)146-53(55)22(89)12-81)50(109)60(62)143-72-63(145-69-45(104)38(97)39(98)51(136-69)20(87)10-79)61(149-153(117,118)126-7-3-77)48(107)52(137-72)21(88)11-80/h20-72,79-109,112H,1-19,75-78H2,(H,110,111)(H,113,114)(H,115,116)(H,117,118)(H,119,120)(H,121,122)/t20-,21-,22+,23+,24+,25+,26+,27-,28-,29+,30+,31+,32?,33+,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+,74+/m0/s1.

What are the key properties of (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid?

(2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid has a molecular weight of 2389.74 g/mol, XLogP of -25.00, 56 rotatable bonds, 42 hydrogen bond donors, and 70 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,4R,5S,6R)-5-[(2R,3S,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-6-[[(2S,3S,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-6-[(1S)-1-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxyethyl]-3,4-dihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-[(2R,3S,4S,5R,6R)-4-[2-aminoethoxy(hydroxy)phosphoryl]oxy-6-[(1S)-1,2-dihydroxyethyl]-3-[(2R,3S,4S,5S,6R)-6-[(1S)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5-hydroxyoxan-2-yl]oxy-3-hydroxy-6-[(1S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]oxan-2-yl]oxy-4-[[2-aminoethoxy(hydroxy)phosphoryl]oxy-hydroxyphosphoryl]oxy-6-[(1R)-1,2-dihydroxyethyl]-2-hydroxyoxane-2-carboxylic acid is sourced from PubChem (CID 171125863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).