LL-N 313
TL;DR: LL-N 313 (CAS 58276-87-2) is a chemical compound with molecular formula C16H22O3 and molecular weight 262.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aR,8S,10S,10aS,10bS)-10-hydroxy-4a,8,10b-trimethyl-2,3,8,9,10,10a-hexahydrobenzo[f]chromen-1-one
Also Known As: Versiol, LL-N313 zeta, LL-N313zeta, ll-N-313, Antibiotic LL-N-313zeta
| Molecular Formula | C16H22O3 |
|---|---|
| Molecular Weight | 262.16 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.1569 |
| Heavy Atoms | 19 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 58276-87-2 |
|---|---|
| SMILES | C[C@H]1C[C@@H]([C@H]2C(=C1)C=C[C@@]3([C@]2(C(=O)CCO3)C)C)O |
| InChIKey | SXHZNZFKZCCMFJ-PIVDIINCSA-N |
Product Overview
LL-N 313 (CAS 58276-87-2), with molecular formula C16H22O3 and molecular weight 262.16 g/mol. IUPAC: (4aR,8S,10S,10aS,10bS)-10-hydroxy-4a,8,10b-trimethyl-2,3,8,9,10,10a-hexahydrobenzo[f]chromen-1-one.
Chemical Property Profile of LL-N 313
Property Insights of LL-N 313
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for LL-N 313. With a topological polar surface area (TPSA) of 46.5 Ų, LL-N 313 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, LL-N 313 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 LL-N 313?
The CAS number of LL-N 313 is 58276-87-2.
What is the molecular formula of LL-N 313?
The molecular formula of LL-N 313 is C16H22O3.
What is the molecular weight of LL-N 313?
The molecular weight of LL-N 313 is 262.16 g/mol.
Where can I buy LL-N 313?
You can request a quote for LL-N 313 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LL-N 313?
Yes, KEHONG BIO provides custom synthesis services for LL-N 313 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.