ML 236C
TL;DR: ML 236C (CAS 58889-18-2) is a chemical compound with molecular formula C18H26O3 and molecular weight 290.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,6R)-6-[2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one
Also Known As: Antibiotic ML 236C, J1.555.927F, (4R,6R)-6-[2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one, 6-(2-(1,2,6,7,8,8a-Hexahydro-2-methyl-1-naphthalenyl)ethyl)tetrahydro-4-hydroxy-2H-pyran-2-one, (4R,6R)-4-hydroxy-6-{2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl}oxan-2-one
| Molecular Formula | C18H26O3 |
|---|---|
| Molecular Weight | 290.19 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.1882 |
| Heavy Atoms | 21 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 58889-18-2 |
|---|---|
| SMILES | C[C@H]1C=CC2=CCCC[C@@H]2[C@H]1CC[C@@H]3C[C@H](CC(=O)O3)O |
| InChIKey | NXIASLUNMKAUTN-WFKFIOEPSA-N |
Product Overview
ML 236C (CAS 58889-18-2), with molecular formula C18H26O3 and molecular weight 290.19 g/mol. IUPAC: (4R,6R)-6-[2-[(1S,2S,8aR)-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one.
Chemical Property Profile of ML 236C
Property Insights of ML 236C
The XLogP value of 3.2 indicates that ML 236C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, ML 236C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ML 236C 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 ML 236C?
The CAS number of ML 236C is 58889-18-2.
What is the molecular formula of ML 236C?
The molecular formula of ML 236C is C18H26O3.
What is the molecular weight of ML 236C?
The molecular weight of ML 236C is 290.19 g/mol.
Where can I buy ML 236C?
You can request a quote for ML 236C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ML 236C?
Yes, KEHONG BIO provides custom synthesis services for ML 236C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.