Anthrasteroid 1
TL;DR: Anthrasteroid 1 (CAS 120542-29-2) is a chemical compound with molecular formula C19H26O2 and molecular weight 286.19327 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,3aS,10aS,11aS,11bS)-3-hydroxy-3a,6-dimethyl-2,3,4,5,9,10,10a,11,11a,11b-decahydro-1H-cyclopenta[a]anthracen-8-one
Also Known As: Anthrasteroid 1, BENZYL TERT-BUTYL IMINODICARBOXYLATE, (3S,3aS,10aS,11aS,11bS)-3-hydroxy-3a,6-dimethyl-2,3,4,5,9,10,10a,11,11a,11b-decahydro-1H-cyclopenta[a]anthracen-8-one, 3-Hydroxy-3,6-dimethyl-2,3,3,4,5,8,9,10,10,11,11,11-dodecahydro-1H-cyclopenta(a)anthracene-8-one, 3beta-Hydroxy-3alpha,beta,6-dimethyl-2,3,3a,4,5,8,9,10,10abeta,11,11abeta,11balpha-dodecahydro-1H-cyclopenta(a)anthracene-8-one
Technical Specifications
| Molecular Formula | C19H26O2 |
| Molecular Weight | 286.19327 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.19327 Da |
| Heavy Atoms | 21 |
| Complexity | 556.0 |
| SMILES | CC1=C2CC[C@]3([C@H]([C@@H]2C[C@H]4C1=CC(=O)CC4)CC[C@@H]3O)C |
| InChIKey | HGULMTJPHPUFCN-WKCWRMMGSA-N |
Chemical Property Profile of Anthrasteroid 1
Property Insights of Anthrasteroid 1
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anthrasteroid 1. With a topological polar surface area (TPSA) of 37.3 Ų, Anthrasteroid 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anthrasteroid 1 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Anthrasteroid 1?
The CAS number of Anthrasteroid 1 is 120542-29-2.
What is the molecular formula of Anthrasteroid 1?
The molecular formula of Anthrasteroid 1 is C19H26O2.
What is the molecular weight of Anthrasteroid 1?
The molecular weight of Anthrasteroid 1 is 286.19327 g/mol.
Where can I buy Anthrasteroid 1?
You can request a quote for Anthrasteroid 1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Anthrasteroid 1?
Yes, CoreyChem provides custom synthesis services for Anthrasteroid 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.