(3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol

C110H184O50 — CID 161024823

About (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol

(3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol (PubChem CID 161024823) has the molecular formula C110H184O50 and a molecular weight of 2306.63 g/mol. Its IUPAC name is (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol.

Molecular Properties

• Compound Name: (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol
• PubChem CID: 161024823
• Molecular Formula: C110H184O50
• Molecular Weight: 2306.63 g/mol
• Exact Mass: 2305.19
• IUPAC Name: (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol
• SMILES: CC1O[C@@H](OC2[C@H](OC3C[C@@H](O)C(CO)O[C@H]3O[C@H]3C(O[C@@H]4OC[C@H](O)[C@@H](O)C4O)[C@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC[C@]57O[C@H](O)[C@]8(C5CC(C)(C)[C@@H](O)[C@@H]8O)[C@H](O)C[C@]76C)C4(C)C)OC(C(=O)O)[C@H]3O)OC(C)[C@H](O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O.CCO.CO.C[C@H]1[C@H](O)C(C)(C)CC2C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC(C(=O)O)[C@@H](O)[C@@H](O[C@@H]7O[C@@H](CO)C(O)[C@@H]7O)C6O[C@@H]6OC(CO)[C@H](O)[C@@H](O)C6O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)[C@@H](O)[C@@H](O)[C@]21CO
• InChI: InChI=1S/C59H96O28.C48H78O20.C2H6O.CH4O/c1-21-32(64)35(67)38(70)49(78-21)85-42-36(68)33(65)22(2)79-50(42)80-25-16-23(61)26(19-60)81-47(25)83-40-39(71)41(46(74)75)84-51(43(40)86-48-37(69)34(66)24(62)20-77-48)82-31-12-13-55(7)27(54(31,5)6)10-14-56(8)28(55)11-15-58-29-17-53(3,4)44(72)45(73)59(29,52(76)87-58)30(63)18-57(56,58)9;1-19-36(58)43(2,3)15-21-20-9-10-25-45(6)13-12-26(44(4,5)24(45)11-14-46(25,7)47(20,8)37(59)38(60)48(19,21)18-51)65-42-35(68-41-31(56)29(54)27(52)22(16-49)63-41)33(32(57)34(67-42)39(61)62)66-40-30(55)28(53)23(17-50)64-40;1-2-3;1-2/h21-45,47-52,60-73,76H,10-20H2,1-9H3,(H,74,75);9,19,21-38,40-42,49-60H,10-18H2,1-8H3,(H,61,62);3H,2H2,1H3;2H,1H3/t21?,22?,23-,24+,25?,26?,27?,28?,29?,30-,31+,32+,33+,34-,35+,36+,37?,38?,39+,40-,41?,42?,43?,44+,45+,47+,48+,49+,50+,51-,52+,55+,56-,57+,58+,59-;19-,21?,22?,23-,24?,25?,26-,27-,28?,29+,30-,31?,32-,33+,34?,35?,36-,37-,38+,40-,41-,42+,45-,46+,47-,48-;;/m10../s1
• InChIKey: TYVNRYAYYMIJRB-QVYREVGYSA-N
• XLogP: -5.34
• TPSA: 818.18 Ų
• H-Bond Donors: 31
• H-Bond Acceptors: 48
• Rotatable Bonds: 22
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2306.63
LogP ≤ 5	-5.34
H-Bond Donors ≤ 5	31
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'saponine_derivative', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol?

The IUPAC name of (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol (CID 161024823) is (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol.

What is the SMILES notation for (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol?

The canonical SMILES for (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol is CC1O[C@@H](OC2[C@H](OC3C[C@@H](O)C(CO)O[C@H]3O[C@H]3C(O[C@@H]4OC[C@H](O)[C@@H](O)C4O)[C@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC[C@]57O[C@H](O)[C@]8(C5CC(C)(C)[C@@H](O)[C@@H]8O)[C@H](O)C[C@]76C)C4(C)C)OC(C(=O)O)[C@H]3O)OC(C)[C@H](O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O.CCO.CO.C[C@H]1[C@H](O)C(C)(C)CC2C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC(C(=O)O)[C@@H](O)[C@@H](O[C@@H]7O[C@@H](CO)C(O)[C@@H]7O)C6O[C@@H]6OC(CO)[C@H](O)[C@@H](O)C6O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)[C@@H](O)[C@@H](O)[C@]21CO.

What is the InChIKey of (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol?

The InChIKey is TYVNRYAYYMIJRB-QVYREVGYSA-N. The full InChI is InChI=1S/C59H96O28.C48H78O20.C2H6O.CH4O/c1-21-32(64)35(67)38(70)49(78-21)85-42-36(68)33(65)22(2)79-50(42)80-25-16-23(61)26(19-60)81-47(25)83-40-39(71)41(46(74)75)84-51(43(40)86-48-37(69)34(66)24(62)20-77-48)82-31-12-13-55(7)27(54(31,5)6)10-14-56(8)28(55)11-15-58-29-17-53(3,4)44(72)45(73)59(29,52(76)87-58)30(63)18-57(56,58)9;1-19-36(58)43(2,3)15-21-20-9-10-25-45(6)13-12-26(44(4,5)24(45)11-14-46(25,7)47(20,8)37(59)38(60)48(19,21)18-51)65-42-35(68-41-31(56)29(54)27(52)22(16-49)63-41)33(32(57)34(67-42)39(61)62)66-40-30(55)28(53)23(17-50)64-40;1-2-3;1-2/h21-45,47-52,60-73,76H,10-20H2,1-9H3,(H,74,75);9,19,21-38,40-42,49-60H,10-18H2,1-8H3,(H,61,62);3H,2H2,1H3;2H,1H3/t21?,22?,23-,24+,25?,26?,27?,28?,29?,30-,31+,32+,33+,34-,35+,36+,37?,38?,39+,40-,41?,42?,43?,44+,45+,47+,48+,49+,50+,51-,52+,55+,56-,57+,58+,59-;19-,21?,22?,23-,24?,25?,26-,27-,28?,29+,30-,31?,32-,33+,34?,35?,36-,37-,38+,40-,41-,42+,45-,46+,47-,48-;;/m10../s1.

What are the key properties of (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol?

(3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol has a molecular weight of 2306.63 g/mol, XLogP of -5.34, 22 rotatable bonds, 31 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for (3S,4R,6R)-6-[[(3S,6aR,6bS,7R,8S,8aR,9R,10S,14bR)-7,8,10-trihydroxy-8a-(hydroxymethyl)-4,4,6a,6b,9,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-[(2S,3S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-5-[(2S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid;(3S,4R,6R)-4-[(2S,5R)-3-[(2S,4S,5R)-4,5-dihydroxy-6-methyl-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-hydroxy-6-[[(1R,2R,4S,5R,10S,13R,17S,21R,22R,23S)-2,21,22,23-tetrahydroxy-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosan-10-yl]oxy]-5-[(2S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid;ethanol;methanol is sourced from PubChem (CID 161024823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).