ODORATONE
TL;DR: ODORATONE (CAS 16962-90-6) is a chemical compound with molecular formula C30H48O4 and molecular weight 472.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-[1-(3,4-dihydroxy-5,5-dimethyloxolan-2-yl)ethyl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: ODORATONE, KBio1_001133, 17-[1-(3,4-dihydroxy-5,5-dimethyloxolan-2-yl)ethyl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one, CID 76311433
| Molecular Formula | C30H48O4 |
|---|---|
| Molecular Weight | 472.36 g/mol |
| LogP | 5.696 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 472.35526 |
| Heavy Atoms | 34 |
| Complexity | 903.4814 |
Chemical Identifiers
| CAS Number | 16962-90-6 |
|---|---|
| SMILES | CC(C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C)C5C(C(C(O5)(C)C)O)O |
Product Overview
ODORATONE (CAS 16962-90-6), with molecular formula C30H48O4 and molecular weight 472.36 g/mol. IUPAC: 17-[1-(3,4-dihydroxy-5,5-dimethyloxolan-2-yl)ethyl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of ODORATONE
Property Insights of ODORATONE
The XLogP value of 5.696 indicates that ODORATONE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ODORATONE. Following Lipinski's Rule of Five, ODORATONE has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ODORATONE?
The CAS number of ODORATONE is 16962-90-6.
What is the molecular formula of ODORATONE?
The molecular formula of ODORATONE is C30H48O4.
What is the molecular weight of ODORATONE?
The molecular weight of ODORATONE is 472.36 g/mol.
Where can I buy ODORATONE?
You can request a quote for ODORATONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ODORATONE?
Yes, KEHONG BIO provides custom synthesis services for ODORATONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.