Mensacarcin
TL;DR: Mensacarcin (CAS 808750-39-2) is a chemical compound with molecular formula C21H24O9 and molecular weight 420.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9S,10S,11S,12S,13S,14R)-11,12,14-trihydroxy-7,9-dimethoxy-13-methyl-12-[(2R,3S)-3-methyloxirane-2-carbonyl]-15-oxatetracyclo[8.4.1.01,10.03,8]pentadeca-3(8),4,6-trien-2-one
Also Known As: Mensacarcin, NCI60_040920, J2.184.586H, (1S,9S,10S,11S,12S,13S,14R)-11,12,14-trihydroxy-7,9-dimethoxy-13-methyl-12-[(2R,3S)-3-methyloxirane-2-carbonyl]-15-oxatetracyclo[8.4.1.01,10.03,8]pentadeca-3(8),4,6-trien-2-one, (1R,2S,3S,4S,4AS,9aS,10S)-1,2,3,4-tetrahydro-1,3,4-trihydroxy-5,10-dimethoxy-2-methyl-3-[[(2R,3S)-3-methyl-2-oxiranyl]carbonyl]-4a,9a-epoxyanthracen-9(10)-one
| Molecular Formula | C21H24O9 |
|---|---|
| Molecular Weight | 420.14 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.14203 |
| Heavy Atoms | 30 |
| Complexity | 786.0 |
Chemical Identifiers
| CAS Number | 808750-39-2 |
|---|---|
| SMILES | C[C@H]1[C@H]([C@@]23C(=O)C4=C([C@@H]([C@@]2(O3)[C@H]([C@@]1(C(=O)[C@H]5[C@@H](O5)C)O)O)OC)C(=CC=C4)OC)O |
| InChIKey | WWNXYRCJJRRWAQ-ALCXHWRFSA-N |
Product Overview
Mensacarcin (CAS 808750-39-2), with molecular formula C21H24O9 and molecular weight 420.14 g/mol. IUPAC: (1S,9S,10S,11S,12S,13S,14R)-11,12,14-trihydroxy-7,9-dimethoxy-13-methyl-12-[(2R,3S)-3-methyloxirane-2-carbonyl]-15-oxatetracyclo[8.4.1.01,10.03,8]pentadeca-3(8),4,6-trien-2-one.
Chemical Property Profile of Mensacarcin
Property Insights of Mensacarcin
The XLogP value of -0.5 indicates that Mensacarcin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mensacarcin. Following Lipinski's Rule of Five, Mensacarcin has 3 hydrogen bond donor(s) and 9 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 Mensacarcin?
The CAS number of Mensacarcin is 808750-39-2.
What is the molecular formula of Mensacarcin?
The molecular formula of Mensacarcin is C21H24O9.
What is the molecular weight of Mensacarcin?
The molecular weight of Mensacarcin is 420.14 g/mol.
Where can I buy Mensacarcin?
You can request a quote for Mensacarcin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mensacarcin?
Yes, KEHONG BIO provides custom synthesis services for Mensacarcin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.