Albomaculine
TL;DR: Albomaculine (CAS 668-63-3) is a chemical compound with molecular formula C19H23NO5 and molecular weight 345.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5aR,11bS,11cS)-8,9,10-trimethoxy-1-methyl-2,3,5,5a,11b,11c-hexahydroisochromeno[3,4-g]indol-7-one
Also Known As: Albomaculine, 8,9,10-Trimethoxy-1-methyllycorenan-7-one, Lycorenan-7-one, 8,9,10-trimethoxy-1-methyl-, (5aR,11bS,11cS)-8,9,10-trimethoxy-1-methyl-2,3,5,5a,11b,11c-hexahydroisochromeno[3,4-g]indol-7-one, (1S,10R,17S)-4,5,6-trimethoxy-16-methyl-9-oxa-16-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2(7),3,5,12-tetraen-8-one
| Molecular Formula | C19H23NO5 |
|---|---|
| Molecular Weight | 345.16 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.15762 |
| Heavy Atoms | 25 |
| Complexity | 564.0 |
Chemical Identifiers
| CAS Number | 668-63-3 |
|---|---|
| SMILES | CN1CCC2=CC[C@@H]3[C@H]([C@@H]21)C4=CC(=C(C(=C4C(=O)O3)OC)OC)OC |
| InChIKey | OXFLPPXWFHSXSK-XNRPHZJLSA-N |
Product Overview
Albomaculine (CAS 668-63-3), with molecular formula C19H23NO5 and molecular weight 345.16 g/mol. IUPAC: (5aR,11bS,11cS)-8,9,10-trimethoxy-1-methyl-2,3,5,5a,11b,11c-hexahydroisochromeno[3,4-g]indol-7-one.
Chemical Property Profile of Albomaculine
Property Insights of Albomaculine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Albomaculine. With a topological polar surface area (TPSA) of 57.2 Ų, Albomaculine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Albomaculine has 0 hydrogen bond donor(s) and 6 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 Albomaculine?
The CAS number of Albomaculine is 668-63-3.
What is the molecular formula of Albomaculine?
The molecular formula of Albomaculine is C19H23NO5.
What is the molecular weight of Albomaculine?
The molecular weight of Albomaculine is 345.16 g/mol.
Where can I buy Albomaculine?
You can request a quote for Albomaculine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Albomaculine?
Yes, KEHONG BIO provides custom synthesis services for Albomaculine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.