Crinipellin B
TL;DR: Crinipellin B (CAS 97294-61-6) is a chemical compound with molecular formula C20H26O4 and molecular weight 330.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-hydroxy-9,12-dimethyl-4-methylidene-13-propan-2-yl-7-oxapentacyclo[7.6.0.01,12.03,8.06,8]pentadecane-5,11-dione
Also Known As: Crinipellin B, 9-Hydroxy-7a,9a-dimethyl-3-methylidene-7-(propan-2-yl)hexahydro-1aH,5H-pentaleno[6a',1':5,6]pentaleno[1,6a-b]oxirene-2,8(3H,6H)-dione
| Molecular Formula | C20H26O4 |
|---|---|
| Molecular Weight | 330.18 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.1831 |
| Heavy Atoms | 24 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 97294-61-6 |
|---|---|
| SMILES | CC(C)C1CCC23C1(C(=O)C(C2(C45C(C3)C(=C)C(=O)C4O5)C)O)C |
| InChIKey | PBZBBNIYZKWVGM-UHFFFAOYSA-N |
Product Overview
Crinipellin B (CAS 97294-61-6), with molecular formula C20H26O4 and molecular weight 330.18 g/mol. IUPAC: 10-hydroxy-9,12-dimethyl-4-methylidene-13-propan-2-yl-7-oxapentacyclo[7.6.0.01,12.03,8.06,8]pentadecane-5,11-dione.
Chemical Property Profile of Crinipellin B
Property Insights of Crinipellin B
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Crinipellin B. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Crinipellin B. Following Lipinski's Rule of Five, Crinipellin B has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Crinipellin B?
The CAS number of Crinipellin B is 97294-61-6.
What is the molecular formula of Crinipellin B?
The molecular formula of Crinipellin B is C20H26O4.
What is the molecular weight of Crinipellin B?
The molecular weight of Crinipellin B is 330.18 g/mol.
Where can I buy Crinipellin B?
You can request a quote for Crinipellin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crinipellin B?
Yes, KEHONG BIO provides custom synthesis services for Crinipellin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.