Glyyunnansapogenin B
TL;DR: Glyyunnansapogenin B (CAS 131179-34-5) is a chemical compound with molecular formula C30H48O5 and molecular weight 488.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4aS,6aR,6aS,6bR,9S,10S,12aR,14bS)-3,10-dihydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
Also Known As: Glyyunnansapogenin B, Glyyunnansapogenin B1, (2S,3R,4aS,6aR,6aS,6bR,9S,10S,12aR,14bS)-3,10-dihydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid, 3,21,23-Trihydroxyolean-12-en-29-oic acid, 3beta,21alpha,24-Trihydroxyolean-12-en-30-oic acid
| Molecular Formula | C30H48O5 |
|---|---|
| Molecular Weight | 488.35 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 488.3502 |
| Heavy Atoms | 35 |
| Complexity | 945.0 |
Chemical Identifiers
| CAS Number | 131179-34-5 |
|---|---|
| SMILES | C[C@@]12CC[C@@]3(C(=CC[C@H]4[C@]3(CCC5[C@@]4(CC[C@@H]([C@]5(C)CO)O)C)C)[C@H]1C[C@]([C@@H](C2)O)(C)C(=O)O)C |
| InChIKey | ZXWLSOQCDSAYHO-CXPCWDADSA-N |
Product Overview
Glyyunnansapogenin B (CAS 131179-34-5), with molecular formula C30H48O5 and molecular weight 488.35 g/mol. IUPAC: (2S,3R,4aS,6aR,6aS,6bR,9S,10S,12aR,14bS)-3,10-dihydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid.
Chemical Property Profile of Glyyunnansapogenin B
Property Insights of Glyyunnansapogenin B
The XLogP value of 6.2 indicates that Glyyunnansapogenin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Glyyunnansapogenin B. Following Lipinski's Rule of Five, Glyyunnansapogenin B has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glyyunnansapogenin B?
The CAS number of Glyyunnansapogenin B is 131179-34-5.
What is the molecular formula of Glyyunnansapogenin B?
The molecular formula of Glyyunnansapogenin B is C30H48O5.
What is the molecular weight of Glyyunnansapogenin B?
The molecular weight of Glyyunnansapogenin B is 488.35 g/mol.
Where can I buy Glyyunnansapogenin B?
You can request a quote for Glyyunnansapogenin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glyyunnansapogenin B?
Yes, KEHONG BIO provides custom synthesis services for Glyyunnansapogenin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.