gymnemoside B
TL;DR: gymnemoside B (CAS 174232-51-0) is a chemical compound with molecular formula C43H66O14 and molecular weight 806.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-6-[[(6aR,6bS,8R,8aS,9S,10S,12aR,14bR)-8-acetyloxy-9-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Gymnemoside b, (2S,3S,4S,5R,6R)-6-[[(6aR,6bS,8R,8aS,9S,10S,12aR,14bR)-8-acetyloxy-9-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid, 16-O-acetyl-21-O-tigloylgymnemagenin 3-O-glucopyranosiduronic acid, beta-D-Glucopyranosiduronic acid, (3beta,4alpha,16beta,21beta(E),22alpha)-16-(acetyloxy)-22,23,28-trihydroxy-21-((2-methyl-1-oxo-2-butenyl)oxy)olean-12-en-3-yl, beta-D-Glucopyranosiduronic acid, (3beta,4alpha,16beta,21beta,22alpha)-16-(acetyloxy)-22,23,28-trihydroxy-21-(((2E)-2-methyl-1-oxo-2-butenyl)oxy)olean-12-en-3-yl
| Molecular Formula | C43H66O14 |
|---|---|
| Molecular Weight | 806.45 g/mol |
| LogP | 3.0305 |
| Topological Polar Surface Area | 229.74 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 806.44525 |
| Heavy Atoms | 57 |
| Complexity | 1658.809 |
Chemical Identifiers
| CAS Number | 174232-51-0 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@@H]1[C@H]([C@@]2([C@@H](C[C@@]3(C(=CCC4[C@]3(CCC5[C@@]4(CCC(C5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)C)C)[C@H]2CC1(C)C)C)OC(=O)C)CO)O |
Product Overview
gymnemoside B (CAS 174232-51-0), with molecular formula C43H66O14 and molecular weight 806.45 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[[(6aR,6bS,8R,8aS,9S,10S,12aR,14bR)-8-acetyloxy-9-hydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(E)-2-methylbut-2-enoyl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of gymnemoside B
Property Insights of gymnemoside B
The XLogP value of 3.0305 indicates that gymnemoside B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 229.74 Ų indicates high polarity, suggesting gymnemoside B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, gymnemoside B has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of gymnemoside B?
The CAS number of gymnemoside B is 174232-51-0.
What is the molecular formula of gymnemoside B?
The molecular formula of gymnemoside B is C43H66O14.
What is the molecular weight of gymnemoside B?
The molecular weight of gymnemoside B is 806.45 g/mol.
Where can I buy gymnemoside B?
You can request a quote for gymnemoside B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for gymnemoside B?
Yes, KEHONG BIO provides custom synthesis services for gymnemoside B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.