豆固醇
TL;DR: 豆固醇 (CAS 83-48-7) is a chemical compound with molecular formula C29H48O and molecular weight 412.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
豆固醇
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Stigmasterin, Phytosterol, STIGMASTEROL, Stigmasta-5,22-dien-3beta-ol, 5,22-Stigmastadien-3
| Molecular Formula | C29H48O |
|---|---|
| Molecular Weight | 412.37 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.3705 |
| Heavy Atoms | 30 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 83-48-7 |
|---|---|
| SMILES | CC[C@H](C=C[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C |
| InChIKey | HCXVJBMSMIARIN-VJSFXXLFSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
豆固醇 (CAS 83-48-7), with molecular formula C29H48O and molecular weight 412.37 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of 豆固醇
Property Insights of 豆固醇
The XLogP value of 8.6 indicates that 豆固醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 豆固醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 豆固醇 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 豆固醇?
The CAS number of 豆固醇 is 83-48-7.
What is the molecular formula of 豆固醇?
The molecular formula of 豆固醇 is C29H48O.
What is the molecular weight of 豆固醇?
The molecular weight of 豆固醇 is 412.37 g/mol.
Where can I buy 豆固醇?
You can request a quote for 豆固醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 豆固醇?
Yes, KEHONG BIO provides custom synthesis services for 豆固醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.