2,3,6,23-四羟基齐墩果-12-烯-28-酸
TL;DR: 2,3,6,23-四羟基齐墩果-12-烯-28-酸 (CAS 37905-13-8) is a chemical compound with molecular formula C30H48O6 and molecular weight 504.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,6,23-四羟基齐墩果-12-烯-28-酸
(4aS,6aR,6aS,6bR,8R,9R,10R,11S,12aR,14bR)-8,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Also Known As: 2,3,6,23-Tetrahydroxyolean-12-en-28-oic acid, (5xi)-2beta,3beta,6beta,23-Tetrahydroxy-18alpha-olean-12-en-28-oic acid
| Molecular Formula | C30H48O6 |
|---|---|
| Molecular Weight | 504.35 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 504.3451 |
| Heavy Atoms | 36 |
| Complexity | 974.0 |
Chemical Identifiers
| CAS Number | 37905-13-8 |
|---|---|
| SMILES | C[C@@]12CC[C@]3(CCC(C[C@@H]3C1=CC[C@H]4[C@]2(C[C@H](C5[C@@]4(C[C@@H]([C@@H]([C@@]5(C)CO)O)O)C)O)C)(C)C)C(=O)O |
| InChIKey | IDQVFXZQPGAVAM-LNFSHTRFSA-N |
Product Overview
2,3,6,23-四羟基齐墩果-12-烯-28-酸 (CAS 37905-13-8), with molecular formula C30H48O6 and molecular weight 504.35 g/mol. IUPAC: (4aS,6aR,6aS,6bR,8R,9R,10R,11S,12aR,14bR)-8,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid.
Chemical Property Profile of 2,3,6,23-四羟基齐墩果-12-烯-28-酸
Property Insights of 2,3,6,23-四羟基齐墩果-12-烯-28-酸
The XLogP value of 4.5 indicates that 2,3,6,23-四羟基齐墩果-12-烯-28-酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,6,23-四羟基齐墩果-12-烯-28-酸. Following Lipinski's Rule of Five, 2,3,6,23-四羟基齐墩果-12-烯-28-酸 has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,6,23-四羟基齐墩果-12-烯-28-酸?
The CAS number of 2,3,6,23-四羟基齐墩果-12-烯-28-酸 is 37905-13-8.
What is the molecular formula of 2,3,6,23-四羟基齐墩果-12-烯-28-酸?
The molecular formula of 2,3,6,23-四羟基齐墩果-12-烯-28-酸 is C30H48O6.
What is the molecular weight of 2,3,6,23-四羟基齐墩果-12-烯-28-酸?
The molecular weight of 2,3,6,23-四羟基齐墩果-12-烯-28-酸 is 504.35 g/mol.
Where can I buy 2,3,6,23-四羟基齐墩果-12-烯-28-酸?
You can request a quote for 2,3,6,23-四羟基齐墩果-12-烯-28-酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,6,23-四羟基齐墩果-12-烯-28-酸?
Yes, KEHONG BIO provides custom synthesis services for 2,3,6,23-四羟基齐墩果-12-烯-28-酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.