Isomarticin
TL;DR: Isomarticin (CAS 19196-46-4) is a chemical compound with molecular formula C18H16O9 and molecular weight 376.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(15R)-3,10-dihydroxy-7-methoxy-13-methyl-5,8-dioxo-14,17-dioxatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,6,9-tetraene-15-carboxylic acid
Also Known As: Isomarticin, (15R)-3,10-dihydroxy-7-methoxy-13-methyl-5,8-dioxo-14,17-dioxatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,6,9-tetraene-15-carboxylic acid, Dibenzyl N-(alpha-carbamoyl-alpha-methylbenzyl)-3-(carboxyamino)succinamate, Succinamic acid, N-(alpha-carbamoyl-alpha-methylbenzyl)-3-(carboxyamino)-, dibenzyl ester, (15R)-3,10-dihydroxy-7-methoxy-13-methyl-5,8-dioxo-14,17-dioxatetracyclo(11.3.1.02,11.04,9)heptadeca-2(11),3,6,9-tetraene-15-carboxylic acid
| Molecular Formula | C18H16O9 |
|---|---|
| Molecular Weight | 376.08 g/mol |
| LogP | 1.2106 |
| Topological Polar Surface Area | 139.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.07944 |
| Heavy Atoms | 27 |
| Complexity | 944.88605 |
Chemical Identifiers
| CAS Number | 19196-46-4 |
|---|---|
| SMILES | CC12CC3=C(C(O1)C[C@@H](O2)C(=O)O)C(=C4C(=O)C=C(C(=O)C4=C3O)OC)O |
Product Overview
Isomarticin (CAS 19196-46-4), with molecular formula C18H16O9 and molecular weight 376.08 g/mol. IUPAC: (15R)-3,10-dihydroxy-7-methoxy-13-methyl-5,8-dioxo-14,17-dioxatetracyclo[11.3.1.02,11.04,9]heptadeca-2(11),3,6,9-tetraene-15-carboxylic acid.
Chemical Property Profile of Isomarticin
Property Insights of Isomarticin
The XLogP value of 1.2106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isomarticin. The TPSA of 139.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Isomarticin. Following Lipinski's Rule of Five, Isomarticin has 3 hydrogen bond donor(s) and 8 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 Isomarticin?
The CAS number of Isomarticin is 19196-46-4.
What is the molecular formula of Isomarticin?
The molecular formula of Isomarticin is C18H16O9.
What is the molecular weight of Isomarticin?
The molecular weight of Isomarticin is 376.08 g/mol.
Where can I buy Isomarticin?
You can request a quote for Isomarticin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isomarticin?
Yes, KEHONG BIO provides custom synthesis services for Isomarticin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.