Momorcharaside B
TL;DR: Momorcharaside B (CAS 134886-64-9) is a chemical compound with molecular formula C36H62O10 and molecular weight 654.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4R,5S,6S)-2-methyl-6-[(9S,10R,13R,14S,17R)-4,4,9,13,14-pentamethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]heptane-2,3,4,5-tetrol
Also Known As: Momorcharaside B, (3R,4R,5S,6S)-2-methyl-6-[(9S,10R,13R,14S,17R)-4,4,9,13,14-pentamethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]heptane-2,3,4,5-tetrol, beta-D-Glucopyranoside, (3beta,9beta,10alpha,22S,23R,24R)-22,23,24,25-tetrahydroxy-9-methyl-19-norlanost-5-en-3-yl
| Molecular Formula | C36H62O10 |
|---|---|
| Molecular Weight | 654.43 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 654.4343 |
| Heavy Atoms | 46 |
| Complexity | 1140.0 |
Chemical Identifiers
| CAS Number | 134886-64-9 |
|---|---|
| SMILES | C[C@@H]([C@H]1CC[C@@]2([C@@]1(CC[C@]3(C2CC=C4[C@@H]3CCC(C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)C)[C@@H]([C@H]([C@H](C(C)(C)O)O)O)O |
| InChIKey | BQQVUJRUVFZIJJ-MCUCJKLQSA-N |
Product Overview
Momorcharaside B (CAS 134886-64-9), with molecular formula C36H62O10 and molecular weight 654.43 g/mol. IUPAC: (3R,4R,5S,6S)-2-methyl-6-[(9S,10R,13R,14S,17R)-4,4,9,13,14-pentamethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]heptane-2,3,4,5-tetrol.
Chemical Property Profile of Momorcharaside B
Property Insights of Momorcharaside B
The XLogP value of 3.2 indicates that Momorcharaside B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting Momorcharaside B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Momorcharaside B has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Momorcharaside B?
The CAS number of Momorcharaside B is 134886-64-9.
What is the molecular formula of Momorcharaside B?
The molecular formula of Momorcharaside B is C36H62O10.
What is the molecular weight of Momorcharaside B?
The molecular weight of Momorcharaside B is 654.43 g/mol.
Where can I buy Momorcharaside B?
You can request a quote for Momorcharaside B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Momorcharaside B?
Yes, KEHONG BIO provides custom synthesis services for Momorcharaside B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.