7beta,12alpha-Dihydroxykaurenolide
TL;DR: 7beta,12alpha-Dihydroxykaurenolide (CAS 62107-03-3) is a chemical compound with molecular formula C20H28O4 and molecular weight 332.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,4S,5R,8R,9R,10R,13R,17S)-4,9-dihydroxy-1,13-dimethyl-6-methylidene-11-oxapentacyclo[8.6.1.15,8.02,8.013,17]octadecan-12-one
Also Known As: 7beta,12alpha-Dihydroxykaurenolide, J2.768.051H, (1S,2S,4S,5R,8R,9R,10R,13R,17S)-4,9-dihydroxy-1,13-dimethyl-6-methylidene-11-oxapentacyclo[8.6.1.15,8.02,8.013,17]octadecan-12-one, 6alpha,7beta,12alpha-Trihydroxykaura-16-ene-18-oic acid gamma-lactone, 7beta,12alpha-Dihydroxy-5beta,6alpha,8alpha,9beta,10alpha,13alpha-6,18-epoxykaur-16-en-18-one
| Molecular Formula | C20H28O4 |
|---|---|
| Molecular Weight | 332.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 332.19876 |
| Heavy Atoms | 24 |
| Complexity | 644.0 |
Chemical Identifiers
| CAS Number | 62107-03-3 |
|---|---|
| SMILES | C[C@@]12CCC[C@@]3([C@H]1[C@H]([C@@H]([C@]45[C@H]2C[C@@H]([C@H](C4)C(=C)C5)O)O)OC3=O)C |
| InChIKey | OSYJLXUUZYSFTC-OTFYASLDSA-N |
Product Overview
7beta,12alpha-Dihydroxykaurenolide (CAS 62107-03-3), with molecular formula C20H28O4 and molecular weight 332.20 g/mol. IUPAC: (1S,2S,4S,5R,8R,9R,10R,13R,17S)-4,9-dihydroxy-1,13-dimethyl-6-methylidene-11-oxapentacyclo[8.6.1.15,8.02,8.013,17]octadecan-12-one.
Chemical Property Profile of 7beta,12alpha-Dihydroxykaurenolide
Property Insights of 7beta,12alpha-Dihydroxykaurenolide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7beta,12alpha-Dihydroxykaurenolide. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 7beta,12alpha-Dihydroxykaurenolide. Following Lipinski's Rule of Five, 7beta,12alpha-Dihydroxykaurenolide has 2 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 7beta,12alpha-Dihydroxykaurenolide?
The CAS number of 7beta,12alpha-Dihydroxykaurenolide is 62107-03-3.
What is the molecular formula of 7beta,12alpha-Dihydroxykaurenolide?
The molecular formula of 7beta,12alpha-Dihydroxykaurenolide is C20H28O4.
What is the molecular weight of 7beta,12alpha-Dihydroxykaurenolide?
The molecular weight of 7beta,12alpha-Dihydroxykaurenolide is 332.20 g/mol.
Where can I buy 7beta,12alpha-Dihydroxykaurenolide?
You can request a quote for 7beta,12alpha-Dihydroxykaurenolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7beta,12alpha-Dihydroxykaurenolide?
Yes, KEHONG BIO provides custom synthesis services for 7beta,12alpha-Dihydroxykaurenolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.