Kallolide A
TL;DR: Kallolide A (CAS 99528-59-3) is a chemical compound with molecular formula C20H24O4 and molecular weight 328.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,9S,10S)-10-hydroxy-12-methyl-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo[9.2.1.13,6]pentadeca-1(13),6(15),11-trien-5-one
Also Known As: kallolide A, NCI60_034894, (2R,3R,9S,10S)-10-hydroxy-12-methyl-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo[9.2.1.13,6]pentadeca-1(13),6(15),11-trien-5-one, (2R,3R,9S,10S)-10-hydroxy-12-methyl-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo(9.2.1.13,6)pentadeca-1(13),6(15),11-trien-5-one, (2R,3R,9S,10S)-12-Methyl-2,9-bis(1-methylethenyl)-10-hydroxy-4,14-dioxatricyclo[9.2.1.13,6]pentadeca-1(13),6(15),11-triene-5-one
| Molecular Formula | C20H24O4 |
|---|---|
| Molecular Weight | 328.17 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.16745 |
| Heavy Atoms | 24 |
| Complexity | 590.0 |
Chemical Identifiers
| CAS Number | 99528-59-3 |
|---|---|
| SMILES | CC1=C2[C@H]([C@@H](CCC3=C[C@H]([C@H](C(=C1)O2)C(=C)C)OC3=O)C(=C)C)O |
| InChIKey | FUKVJHCKIJOHPW-RANZSIQMSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Kallolide A (CAS 99528-59-3), with molecular formula C20H24O4 and molecular weight 328.17 g/mol. IUPAC: (2R,3R,9S,10S)-10-hydroxy-12-methyl-2,9-bis(prop-1-en-2-yl)-4,14-dioxatricyclo[9.2.1.13,6]pentadeca-1(13),6(15),11-trien-5-one.
Chemical Property Profile of Kallolide A
Property Insights of Kallolide A
The XLogP value of 4.0 indicates that Kallolide A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.7 Ų, Kallolide A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Kallolide A 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 Kallolide A?
The CAS number of Kallolide A is 99528-59-3.
What is the molecular formula of Kallolide A?
The molecular formula of Kallolide A is C20H24O4.
What is the molecular weight of Kallolide A?
The molecular weight of Kallolide A is 328.17 g/mol.
Where can I buy Kallolide A?
You can request a quote for Kallolide A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kallolide A?
Yes, KEHONG BIO provides custom synthesis services for Kallolide A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.