CID 99511
TL;DR: CID 99511 (CAS 32507-77-0) is a chemical compound with molecular formula C28H44O and molecular weight 396.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9R,10S,13R,14R,17R)-17-[(2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: Ergosta-7,22-dien-3-one, Ergost-7,22-diene-3-ol, (24R)-24-Methylcholesta-7,22-dien-3-one, J1.033.253B, (1R,3aR,9aS,9bR,11aR)-1-[(2R,5R)-5,6-dimethylhept-3-en-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
| Molecular Formula | C28H44O |
|---|---|
| Molecular Weight | 396.34 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.3392 |
| Heavy Atoms | 29 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 32507-77-0 |
|---|---|
| SMILES | C[C@H](C=C[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CCC4[C@@]3(CCC(=O)C4)C)C |
| InChIKey | AHWOEMBXZXGDBQ-AQGSFBQWSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CID 99511 (CAS 32507-77-0), with molecular formula C28H44O and molecular weight 396.34 g/mol. IUPAC: (9R,10S,13R,14R,17R)-17-[(2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of CID 99511
Property Insights of CID 99511
The XLogP value of 7.3 indicates that CID 99511 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, CID 99511 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CID 99511 has 0 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 CID 99511?
The CAS number of CID 99511 is 32507-77-0.
What is the molecular formula of CID 99511?
The molecular formula of CID 99511 is C28H44O.
What is the molecular weight of CID 99511?
The molecular weight of CID 99511 is 396.34 g/mol.
Where can I buy CID 99511?
You can request a quote for CID 99511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 99511?
Yes, KEHONG BIO provides custom synthesis services for CID 99511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.