disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate

C90H120N4Na2O46 — CID 90664197

About disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate

disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate (PubChem CID 90664197) has the molecular formula C90H120N4Na2O46 and a molecular weight of 2039.91 g/mol. Its IUPAC name is disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate.

Molecular Properties

• Compound Name: disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate
• PubChem CID: 90664197
• Molecular Formula: C90H120N4Na2O46
• Molecular Weight: 2039.91 g/mol
• Exact Mass: 2038.70
• IUPAC Name: disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate
• SMILES: CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](O[C@H]2[C@@H](O)[C@@H](O[C@@H]3C(O[C@H]4O[C@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](NC(=O)c4ccc5ccccc5c4)[C@@H](OCCc4cccc(CCO[C@@H]5O[C@@H](CO)[C@@H](O[C@@H]6O[C@@H](CO)[C@H](O)[C@H](O[C@]7(C(=O)[O-])C[C@@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O7)[C@@H]6O)[C@H](O[C@@H]6O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]6O)[C@@H]5NC(=O)c5ccc6ccccc6c5)c4)O[C@@H]3CO)O[C@H](CO)[C@H]2O)(C(=O)[O-])C[C@@H]1O.[Na+].[Na+]
• InChI: InChI=1S/C90H122N4O46.2Na/c1-35-59(107)65(113)67(115)83(127-35)135-75-57(93-79(119)45-18-16-41-12-5-7-14-43(41)25-45)81(131-53(33-99)71(75)133-85-69(117)77(63(111)51(31-97)129-85)139-89(87(121)122)27-47(103)55(91-37(3)101)73(137-89)61(109)49(105)29-95)125-22-20-39-10-9-11-40(24-39)21-23-126-82-58(94-80(120)46-19-17-42-13-6-8-15-44(42)26-46)76(136-84-68(116)66(114)60(108)36(2)128-84)72(54(34-100)132-82)134-86-70(118)78(64(112)52(32-98)130-86)140-90(88(123)124)28-48(104)56(92-38(4)102)74(138-90)62(110)50(106)30-96;;/h5-19,24-26,35-36,47-78,81-86,95-100,103-118H,20-23,27-34H2,1-4H3,(H,91,101)(H,92,102)(H,93,119)(H,94,120)(H,121,122)(H,123,124);;/q;2*+1/p-2/t35-,36+,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+,81+,82-,83-,84+,85-,86+,89-,90+;;/m1../s1
• InChIKey: OAJDIWODZAVCPU-CVHYMEEZSA-L
• XLogP: -19.38
• TPSA: 789.40 Ų
• H-Bond Donors: 26
• H-Bond Acceptors: 46
• Rotatable Bonds: 38
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2039.91
LogP ≤ 5	-19.38
H-Bond Donors ≤ 5	26
H-Bond Acceptors ≤ 10	46

Frequently Asked Questions

What is the IUPAC name of disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate?

The IUPAC name of disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate (CID 90664197) is disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate.

What is the SMILES notation for disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate?

The canonical SMILES for disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate is CC(=O)N[C@@H]1[C@@H]([C@H](O)[C@H](O)CO)O[C@](O[C@H]2[C@@H](O)[C@@H](O[C@@H]3C(O[C@H]4O[C@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](NC(=O)c4ccc5ccccc5c4)[C@@H](OCCc4cccc(CCO[C@@H]5O[C@@H](CO)[C@@H](O[C@@H]6O[C@@H](CO)[C@H](O)[C@H](O[C@]7(C(=O)[O-])C[C@@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O7)[C@@H]6O)[C@H](O[C@@H]6O[C@@H](C)[C@@H](O)[C@H](O)[C@@H]6O)[C@@H]5NC(=O)c5ccc6ccccc6c5)c4)O[C@@H]3CO)O[C@H](CO)[C@H]2O)(C(=O)[O-])C[C@@H]1O.[Na+].[Na+].

What is the InChIKey of disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate?

The InChIKey is OAJDIWODZAVCPU-CVHYMEEZSA-L. The full InChI is InChI=1S/C90H122N4O46.2Na/c1-35-59(107)65(113)67(115)83(127-35)135-75-57(93-79(119)45-18-16-41-12-5-7-14-43(41)25-45)81(131-53(33-99)71(75)133-85-69(117)77(63(111)51(31-97)129-85)139-89(87(121)122)27-47(103)55(91-37(3)101)73(137-89)61(109)49(105)29-95)125-22-20-39-10-9-11-40(24-39)21-23-126-82-58(94-80(120)46-19-17-42-13-6-8-15-44(42)26-46)76(136-84-68(116)66(114)60(108)36(2)128-84)72(54(34-100)132-82)134-86-70(118)78(64(112)52(32-98)130-86)140-90(88(123)124)28-48(104)56(92-38(4)102)74(138-90)62(110)50(106)30-96;;/h5-19,24-26,35-36,47-78,81-86,95-100,103-118H,20-23,27-34H2,1-4H3,(H,91,101)(H,92,102)(H,93,119)(H,94,120)(H,121,122)(H,123,124);;/q;2*+1/p-2/t35-,36+,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+,81+,82-,83-,84+,85-,86+,89-,90+;;/m1../s1.

What are the key properties of disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate?

disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate has a molecular weight of 2039.91 g/mol, XLogP of -19.38, 38 rotatable bonds, 26 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for disodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6R)-6-[2-[3-[2-[(2S,3R,4S,5R,6R)-5-[(2R,3R,4R,5R,6R)-4-[(2R,4S,5S,6S)-5-acetamido-2-carboxylato-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)-3-(naphthalene-2-carbonylamino)-4-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxyethyl]phenyl]ethoxy]-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate is sourced from PubChem (CID 90664197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).