Jatropholone
TL;DR: Jatropholone (CAS 71424-66-3) is a chemical compound with molecular formula C20H24O2 and molecular weight 296.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-4,8,11,11-tetramethyl-15-methylidenetetracyclo[7.6.0.02,6.010,12]pentadeca-1,6,8-trien-3-one
Also Known As: jatropholone B, Jatropholone A, JATROPHOLONE, (1aR)-1,1abeta,4,5,7,8,9,9abeta-Octahydro-3-hydroxy-1,1,2,5beta-tetramethyl-7-methylene-6H-cyclopropa[3,4]cyclohept[1,2-e]inden-6-one, (1aR)-1,1a
| Molecular Formula | C20H24O2 |
|---|---|
| Molecular Weight | 296.18 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.17764 |
| Heavy Atoms | 22 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 71424-66-3 |
|---|---|
| SMILES | CC1CC2=C(C(=C3C4C(C4(C)C)CCC(=C)C3=C2C1=O)C)O |
| InChIKey | BMHPRIPRPDSKRK-UHFFFAOYSA-N |
Product Overview
Jatropholone (CAS 71424-66-3), with molecular formula C20H24O2 and molecular weight 296.18 g/mol. IUPAC: 7-hydroxy-4,8,11,11-tetramethyl-15-methylidenetetracyclo[7.6.0.02,6.010,12]pentadeca-1,6,8-trien-3-one.
Chemical Property Profile of Jatropholone
Property Insights of Jatropholone
The XLogP value of 4.5 indicates that Jatropholone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Jatropholone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Jatropholone has 1 hydrogen bond donor(s) and 2 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 Jatropholone?
The CAS number of Jatropholone is 71424-66-3.
What is the molecular formula of Jatropholone?
The molecular formula of Jatropholone is C20H24O2.
What is the molecular weight of Jatropholone?
The molecular weight of Jatropholone is 296.18 g/mol.
Where can I buy Jatropholone?
You can request a quote for Jatropholone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Jatropholone?
Yes, KEHONG BIO provides custom synthesis services for Jatropholone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.