(2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid

C44H67NO34 — CID 91860281

IUPAC(2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid
SMILESCO[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O[C@H]3O[C@H](C(=O)O)[C@@H](O[C@@H]4OC[C@@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](OC)[C@H](O)[C@H]6NC(C)=O)[C@H](O)[C@H]5O)[C@H](OC(C)=O)[C@H]4OC(C)=O)[C@H](O)[C@H]3OC)[C@@H](O)O[C@@H]2CO)O[C@@H](C)[C@H](O)[C@H]1O
InChIInChI=1S/C44H67NO34/c1-10-17(50)19(52)30(65-6)43(68-10)73-24-14(8-46)71-39(63)29(22(24)55)76-44-31(66-7)23(56)28(34(79-44)38(61)62)75-42-35(70-13(4)49)25(69-12(3)48)15(9-67-42)72-41-21(54)20(53)27(33(78-41)37(59)60)74-40-16(45-11(2)47)18(51)26(64-5)32(77-40)36(57)58/h10,14-35,39-44,46,50-56,63H,8-9H2,1-7H3,(H,45,47)(H,57,58)(H,59,60)(H,61,62)/t10-,14+,15+,16+,17-,18+,19+,20+,21+,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+,32-,33-,34-,35+,39-,40+,41+,42-,43-,44-/m0/s1
InChIKeyONAMSCWVGHCABG-KSZUNPHHSA-N
MW1153.99 g/mol
LogP-8.91
Rot. Bonds20

About (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid

(2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid (PubChem CID 91860281) has the molecular formula C44H67NO34 and a molecular weight of 1153.99 g/mol. Its IUPAC name is (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid.

Molecular Properties

Compound Name(2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid
PubChem CID91860281
Molecular FormulaC44H67NO34
Molecular Weight1153.99 g/mol
Exact Mass1153.35
IUPAC Name(2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid
SMILESCO[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O[C@H]3O[C@H](C(=O)O)[C@@H](O[C@@H]4OC[C@@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](OC)[C@H](O)[C@H]6NC(C)=O)[C@H](O)[C@H]5O)[C@H](OC(C)=O)[C@H]4OC(C)=O)[C@H](O)[C@H]3OC)[C@@H](O)O[C@@H]2CO)O[C@@H](C)[C@H](O)[C@H]1O
InChIInChI=1S/C44H67NO34/c1-10-17(50)19(52)30(65-6)43(68-10)73-24-14(8-46)71-39(63)29(22(24)55)76-44-31(66-7)23(56)28(34(79-44)38(61)62)75-42-35(70-13(4)49)25(69-12(3)48)15(9-67-42)72-41-21(54)20(53)27(33(78-41)37(59)60)74-40-16(45-11(2)47)18(51)26(64-5)32(77-40)36(57)58/h10,14-35,39-44,46,50-56,63H,8-9H2,1-7H3,(H,45,47)(H,57,58)(H,59,60)(H,61,62)/t10-,14+,15+,16+,17-,18+,19+,20+,21+,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+,32-,33-,34-,35+,39-,40+,41+,42-,43-,44-/m0/s1
InChIKeyONAMSCWVGHCABG-KSZUNPHHSA-N
XLogP-8.91
TPSA504.89 Ų
H-Bond Donors13
H-Bond Acceptors31
Rotatable Bonds20
Heavy Atoms79
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001153.99
LogP ≤ 5-8.91
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1031

Analyze (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

(2S,3S,4R,5R,6S)-6-[(2S,3S,4S,5S,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3-[(2S,3R,4R,5R)-5-[(2S,3S,4R,5S,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid
CID 91858744
(2S,3R,4S,5R,6R)-6-[(2R,3R,4R,5R,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-5-acetyloxy-3-[(2R,3R,4R,5R,6S)-3-[(2S,3R,4R,5S,6S)-4-acetyloxy-3,5-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxyoxane-2-carboxylic acid
CID 86289639
(3S,5S,6R)-3-[(2R,4R,5S)-3-acetamido-5-[(2R,3S,5S)-5-[(2R,4R,5S)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-ethoxy-4,5-dihydroxyoxane-2-carboxylic acid
CID 121419412
(2S,3S,4R,5R,6S)-6-[(2S,3S,4S,5S,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid
CID 91845328
(2S,3S,4R,5R,6R)-3-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-[(2S,3S,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxane-2-carboxylic acid
CID 171122664
N-[(2R,3R,4R,5R,6R)-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R)-4,6-dihydroxy-2-(hydroxymethyl)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 146015523
(2S,3S,4R,5R,6R)-3-[(2R,3R,4R,5S,6R)-3-acetamido-5-[(2R,3R,4R,5S,6S)-5-[(2R,3R,4R,5S,6R)-3-acetamido-5-[(2R,3R,4R,5S,6S)-5-[(2R,3R,4R,5S,6R)-3-acetamido-5-[(2R,3R,4R,5S,6S)-5-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-[(2R,3S,4R,5R)-4-hydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl]oxyoxane-2-carboxylic acid
CID 91860349
N-[(2R,3R,4R,5S,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]acetamide
CID 56992651
N-[(2R,3S,5S)-5-[(2S,3S,5R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide
CID 168831152
(2S,3S,4R,5R,6S)-6-[(2S,3S,4R,5R,6S)-2-[(2R,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl]oxy-3-[(2R,3R,4R,5S,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxane-2-carboxylic acid
CID 91851692
(2S,3S,4R,5R,6R)-6-[(2S,3R,4S,5S,6S)-6-[(2R,3S,4R,5R,6S)-5-acetamido-6-[(2R,3S,4S,5S,6R)-2-[(2S,3S,4S,5R,6R)-2-[[(1R,2S,3R,4R,5R)-3,4-dihydroxy-6,8-dioxabicyclo[3.2.1]octan-2-yl]oxy]-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-[(2R,3R,4R,5R,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-methoxyoxan-2-yl]oxy-5-hydroxy-2-methyloxan-3-yl]oxy-4,5-dihydroxy-3-methoxyoxane-2-carboxylic acid
CID 11007749
(2S,3S,4R,5S,6R)-5-acetamido-6-[(2S,3S,4S,5R,6S)-3-acetamido-2-[(2S,3R,4R,5S,6R)-3-acetamido-5-hydroxy-2-methoxy-6-methyloxan-4-yl]oxy-5-hydroxy-6-methyloxan-4-yl]oxy-3-acetyloxy-4-methoxyoxane-2-carboxylic acid
CID 122404185

Frequently Asked Questions

What is the IUPAC name of (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid?
The IUPAC name of (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid (CID 91860281) is (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid.
What is the SMILES notation for (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid?
The canonical SMILES for (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid is CO[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O[C@H]3O[C@H](C(=O)O)[C@@H](O[C@@H]4OC[C@@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](OC)[C@H](O)[C@H]6NC(C)=O)[C@H](O)[C@H]5O)[C@H](OC(C)=O)[C@H]4OC(C)=O)[C@H](O)[C@H]3OC)[C@@H](O)O[C@@H]2CO)O[C@@H](C)[C@H](O)[C@H]1O.
What is the InChIKey of (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid?
The InChIKey is ONAMSCWVGHCABG-KSZUNPHHSA-N. The full InChI is InChI=1S/C44H67NO34/c1-10-17(50)19(52)30(65-6)43(68-10)73-24-14(8-46)71-39(63)29(22(24)55)76-44-31(66-7)23(56)28(34(79-44)38(61)62)75-42-35(70-13(4)49)25(69-12(3)48)15(9-67-42)72-41-21(54)20(53)27(33(78-41)37(59)60)74-40-16(45-11(2)47)18(51)26(64-5)32(77-40)36(57)58/h10,14-35,39-44,46,50-56,63H,8-9H2,1-7H3,(H,45,47)(H,57,58)(H,59,60)(H,61,62)/t10-,14+,15+,16+,17-,18+,19+,20+,21+,22-,23-,24+,25-,26-,27-,28-,29-,30+,31+,32-,33-,34-,35+,39-,40+,41+,42-,43-,44-/m0/s1.
What are the key properties of (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid?
(2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid has a molecular weight of 1153.99 g/mol, XLogP of -8.91, 20 rotatable bonds, 13 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,4R,5R,6R)-5-acetamido-6-[(2S,3S,4R,5R,6R)-2-carboxy-6-[(3R,4S,5R,6S)-4,5-diacetyloxy-6-[(2S,3S,4S,5R,6S)-2-carboxy-6-[(2S,3S,4S,5S,6R)-5-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-5-methoxyoxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-4-hydroxy-3-methoxyoxane-2-carboxylic acid is sourced from PubChem (CID 91860281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).