Candimine
TL;DR: Candimine (CAS 24585-19-1) is a chemical compound with molecular formula C18H19NO6 and molecular weight 345.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,9S,10S)-9-hydroxy-14-methoxy-4-methyl-11,16,18-trioxa-4-azapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),7,13,15(19)-tetraen-12-one
Also Known As: Candimine, J2.766.082G, (2S,3S,9S,10S)-9-hydroxy-14-methoxy-4-methyl-11,16,18-trioxa-4-azapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),7,13,15(19)-tetraen-12-one, 5alpha-Hydroxy-8-methoxy-1-methyl-9,10-(methylenebisoxy)lycorenan-7-one, (2S,3S,9S,10S)-9-hydroxy-14-methoxy-4-methyl-11,16,18-trioxa-4-azapentacyclo(11.7.0.02,10.03,7.015,19)icosa-1(20),7,13,15(19)-tetraen-12-one
| Molecular Formula | C18H19NO6 |
|---|---|
| Molecular Weight | 345.12 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 77.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 345.12125 |
| Heavy Atoms | 25 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 24585-19-1 |
|---|---|
| SMILES | CN1CCC2=C[C@@H]([C@@H]3[C@H]([C@@H]21)C4=CC5=C(C(=C4C(=O)O3)OC)OCO5)O |
| InChIKey | OLGJGNBIBXKMJN-OBCWZRDOSA-N |
Product Overview
Candimine (CAS 24585-19-1), with molecular formula C18H19NO6 and molecular weight 345.12 g/mol. IUPAC: (2S,3S,9S,10S)-9-hydroxy-14-methoxy-4-methyl-11,16,18-trioxa-4-azapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),7,13,15(19)-tetraen-12-one.
Chemical Property Profile of Candimine
Property Insights of Candimine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Candimine. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Candimine. Following Lipinski's Rule of Five, Candimine has 1 hydrogen bond donor(s) and 7 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 Candimine?
The CAS number of Candimine is 24585-19-1.
What is the molecular formula of Candimine?
The molecular formula of Candimine is C18H19NO6.
What is the molecular weight of Candimine?
The molecular weight of Candimine is 345.12 g/mol.
Where can I buy Candimine?
You can request a quote for Candimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Candimine?
Yes, KEHONG BIO provides custom synthesis services for Candimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.