羟胆甾醇
TL;DR: 羟胆甾醇 (CAS 4025-59-6) is a chemical compound with molecular formula C27H46O2 and molecular weight 402.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟胆甾醇
(1S,2R,5S,7S,9R,11S,12S,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-ol
Also Known As: Cholesterol beta-epoxide, Epoxycholesterol, beta-epoxycholesterol, Cholesterol 5beta,6beta-epoxide, 5beta,6beta-EpoxyC
| Molecular Formula | C27H46O2 |
|---|---|
| Molecular Weight | 402.35 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.3498 |
| Heavy Atoms | 29 |
| Complexity | 630.0 |
Chemical Identifiers
| CAS Number | 4025-59-6 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]4[C@]5([C@@]3(CC[C@@H](C5)O)C)O4)C |
| InChIKey | PRYIJAGAEJZDBO-DTLXENBRSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟胆甾醇 (CAS 4025-59-6), with molecular formula C27H46O2 and molecular weight 402.35 g/mol. IUPAC: (1S,2R,5S,7S,9R,11S,12S,15R,16R)-2,16-dimethyl-15-[(2R)-6-methylheptan-2-yl]-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-ol.
Chemical Property Profile of 羟胆甾醇
Property Insights of 羟胆甾醇
The XLogP value of 8.0 indicates that 羟胆甾醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 羟胆甾醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 羟胆甾醇 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 羟胆甾醇?
The CAS number of 羟胆甾醇 is 4025-59-6.
What is the molecular formula of 羟胆甾醇?
The molecular formula of 羟胆甾醇 is C27H46O2.
What is the molecular weight of 羟胆甾醇?
The molecular weight of 羟胆甾醇 is 402.35 g/mol.
Where can I buy 羟胆甾醇?
You can request a quote for 羟胆甾醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟胆甾醇?
Yes, KEHONG BIO provides custom synthesis services for 羟胆甾醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.