Lactaroscrobiculide B
TL;DR: Lactaroscrobiculide B (CAS 72601-38-8) is a chemical compound with molecular formula C15H20O3 and molecular weight 248.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S,5aS)-5-hydroxy-5,7,7-trimethyl-4,5a,6,8-tetrahydro-3H-azuleno[5,6-c]furan-1-one
Also Known As: Lactaroscrobiculide B, Azuleno(5,6-c)furan-3(1H)-one, 5,6,7,7a,8,9-hexahydro-8-hydroxy-6,6,8-trimethyl-, (7aS,8S)-, (5S,5aS)-5-hydroxy-5,7,7-trimethyl-4,5a,6,8-tetrahydro-3H-azuleno[5,6-c]furan-1-one, Benzamide, 3-chloro-N-(3-(5-methoxy-1H-indol-3-yl)propyl)-, (5S,5aS)-5-hydroxy-5,7,7-trimethyl-4,5a,6,8-tetrahydro-3H-azuleno(5,6-c)furan-1-one
| Molecular Formula | C15H20O3 |
|---|---|
| Molecular Weight | 248.14 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.14125 |
| Heavy Atoms | 18 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 72601-38-8 |
|---|---|
| SMILES | C[C@@]1(CC2=C(C=C3[C@@H]1CC(C3)(C)C)C(=O)OC2)O |
| InChIKey | UAGRYLZLTBLSDQ-WFASDCNBSA-N |
Product Overview
Lactaroscrobiculide B (CAS 72601-38-8), with molecular formula C15H20O3 and molecular weight 248.14 g/mol. IUPAC: (5S,5aS)-5-hydroxy-5,7,7-trimethyl-4,5a,6,8-tetrahydro-3H-azuleno[5,6-c]furan-1-one.
Chemical Property Profile of Lactaroscrobiculide B
Property Insights of Lactaroscrobiculide B
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lactaroscrobiculide B. With a topological polar surface area (TPSA) of 46.5 Ų, Lactaroscrobiculide B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lactaroscrobiculide B has 1 hydrogen bond donor(s) and 3 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 Lactaroscrobiculide B?
The CAS number of Lactaroscrobiculide B is 72601-38-8.
What is the molecular formula of Lactaroscrobiculide B?
The molecular formula of Lactaroscrobiculide B is C15H20O3.
What is the molecular weight of Lactaroscrobiculide B?
The molecular weight of Lactaroscrobiculide B is 248.14 g/mol.
Where can I buy Lactaroscrobiculide B?
You can request a quote for Lactaroscrobiculide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lactaroscrobiculide B?
Yes, KEHONG BIO provides custom synthesis services for Lactaroscrobiculide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.