阿多甾醇
TL;DR: 阿多甾醇 (CAS 55623-03-5) is a chemical compound with molecular formula C27H45IO and molecular weight 512.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
阿多甾醇
(3S,6R,8S,9S,13R,14S,17R)-6-(iodomethyl)-13-methyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol
Also Known As: ADOSTEROL, adosterol (incomplete stereochemistry), (3S,6R,8S,9S,13R,14S,17R)-6-(iodomethyl)-13-methyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol
| Molecular Formula | C27H45IO |
|---|---|
| Molecular Weight | 512.25 g/mol |
| LogP | 8.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 512.2515 |
| Heavy Atoms | 29 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 55623-03-5 |
|---|---|
| SMILES | CC(C)CCCC(C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H](C4=C3CC[C@@H](C4)O)CI)C |
| InChIKey | QJHZPCLORSPENH-WJXGYAGSSA-N |
Product Overview
阿多甾醇 (CAS 55623-03-5), with molecular formula C27H45IO and molecular weight 512.25 g/mol. IUPAC: (3S,6R,8S,9S,13R,14S,17R)-6-(iodomethyl)-13-methyl-17-(6-methylheptan-2-yl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of 阿多甾醇
Property Insights of 阿多甾醇
The XLogP value of 8.8 indicates that 阿多甾醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 阿多甾醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 阿多甾醇 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 阿多甾醇?
The CAS number of 阿多甾醇 is 55623-03-5.
What is the molecular formula of 阿多甾醇?
The molecular formula of 阿多甾醇 is C27H45IO.
What is the molecular weight of 阿多甾醇?
The molecular weight of 阿多甾醇 is 512.25 g/mol.
Where can I buy 阿多甾醇?
You can request a quote for 阿多甾醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 阿多甾醇?
Yes, KEHONG BIO provides custom synthesis services for 阿多甾醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.