Chaparrinone triacetate,15-dehydro-
TL;DR: Chaparrinone triacetate,15-dehydro- (CAS 79752-54-8) is a chemical compound with molecular formula C26H30O10 and molecular weight 502.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,15-diacetyloxy-2,6,14-trimethyl-4,11,16-trioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-5,12-dien-17-yl)methyl acetate
Also Known As: CHAPARRINONE TRIACETATE,15-DEHYDRO-, .DELTA.14,15-Chaparrinone triacetate, 2,11,16-Trioxopicrasa-3,14-diene-1,12,20-triyl triacetate
| Molecular Formula | C26H30O10 |
|---|---|
| Molecular Weight | 502.18 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 502.1839 |
| Heavy Atoms | 36 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 79752-54-8 |
|---|---|
| SMILES | CC1C(C(=O)C2C3(C(CC4C2(C1=CC(=O)O4)COC(=O)C)C(=CC(=O)C3OC(=O)C)C)C)OC(=O)C |
| InChIKey | VYQXUJXNZSWNRT-UHFFFAOYSA-N |
Product Overview
Chaparrinone triacetate,15-dehydro- (CAS 79752-54-8), with molecular formula C26H30O10 and molecular weight 502.18 g/mol. IUPAC: (3,15-diacetyloxy-2,6,14-trimethyl-4,11,16-trioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-5,12-dien-17-yl)methyl acetate.
Chemical Property Profile of Chaparrinone triacetate,15-dehydro-
Property Insights of Chaparrinone triacetate,15-dehydro-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chaparrinone triacetate,15-dehydro-. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Chaparrinone triacetate,15-dehydro-. Following Lipinski's Rule of Five, Chaparrinone triacetate,15-dehydro- has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chaparrinone triacetate,15-dehydro-?
The CAS number of Chaparrinone triacetate,15-dehydro- is 79752-54-8.
What is the molecular formula of Chaparrinone triacetate,15-dehydro-?
The molecular formula of Chaparrinone triacetate,15-dehydro- is C26H30O10.
What is the molecular weight of Chaparrinone triacetate,15-dehydro-?
The molecular weight of Chaparrinone triacetate,15-dehydro- is 502.18 g/mol.
Where can I buy Chaparrinone triacetate,15-dehydro-?
You can request a quote for Chaparrinone triacetate,15-dehydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chaparrinone triacetate,15-dehydro-?
Yes, KEHONG BIO provides custom synthesis services for Chaparrinone triacetate,15-dehydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.