Oteromycin
TL;DR: Oteromycin (CAS 170591-45-4) is a chemical compound with molecular formula C32H41NO3 and molecular weight 487.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3,4a,6-trimethyl-2-(4-methylhexa-2,4-dien-2-yl)-2,5,6,7,8,8a-hexahydro-1H-naphthalene-1-carbonyl]-5-benzyl-5-hydroxy-1H-pyrrol-2-one
Also Known As: Oteromycin, 3-[3,4a,6-Trimethyl-2-(4-methylhexa-2,4-dien-2-yl)-2,5,6,7,8,8a-hexahydro-1H-naphthalene-1-carbonyl]-5-benzyl-5-hydroxy-1H-pyrrol-2-one
| Molecular Formula | C32H41NO3 |
|---|---|
| Molecular Weight | 487.31 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 487.30865 |
| Heavy Atoms | 36 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 170591-45-4 |
|---|---|
| SMILES | CC=C(C)C=C(C)C1C(C2CCC(CC2(C=C1C)C)C)C(=O)C3=CC(NC3=O)(CC4=CC=CC=C4)O |
| InChIKey | LERBUEGMFSDFOI-UHFFFAOYSA-N |
Product Overview
Oteromycin (CAS 170591-45-4), with molecular formula C32H41NO3 and molecular weight 487.31 g/mol. IUPAC: 3-[3,4a,6-trimethyl-2-(4-methylhexa-2,4-dien-2-yl)-2,5,6,7,8,8a-hexahydro-1H-naphthalene-1-carbonyl]-5-benzyl-5-hydroxy-1H-pyrrol-2-one.
Chemical Property Profile of Oteromycin
Property Insights of Oteromycin
The XLogP value of 7.3 indicates that Oteromycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Oteromycin. Following Lipinski's Rule of Five, Oteromycin has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Oteromycin?
The CAS number of Oteromycin is 170591-45-4.
What is the molecular formula of Oteromycin?
The molecular formula of Oteromycin is C32H41NO3.
What is the molecular weight of Oteromycin?
The molecular weight of Oteromycin is 487.31 g/mol.
Where can I buy Oteromycin?
You can request a quote for Oteromycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oteromycin?
Yes, KEHONG BIO provides custom synthesis services for Oteromycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.