Oracon
TL;DR: Oracon (CAS 8015-19-8) is a chemical compound with molecular formula C43H56O4 and molecular weight 636.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Oracon
(8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol;(6S,8R,9S,10R,13S,14S,17S)-17-hydroxy-6,10,13-trimethyl-17-prop-1-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: Oracon, Secrovin, OVIN, Dimethisterone and ethinyl estradiol, Ethinyl estradiol and dimethisterone
| Molecular Formula | C43H56O4 |
|---|---|
| Molecular Weight | 636.42 g/mol |
| LogP | 8.13 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 636.41785 |
| Heavy Atoms | 47 |
| Complexity | 1210.0 |
Chemical Identifiers
| CAS Number | 8015-19-8 |
|---|---|
| SMILES | CC#C[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H](C4=CC(=O)CC[C@]34C)C)C)O.C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O |
| InChIKey | KKVNENSFUWDQCF-BWHNGHDOSA-N |
Product Overview
Oracon (CAS 8015-19-8), with molecular formula C43H56O4 and molecular weight 636.42 g/mol. IUPAC: (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol;(6S,8R,9S,10R,13S,14S,17S)-17-hydroxy-6,10,13-trimethyl-17-prop-1-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Oracon
Property Insights of Oracon
The XLogP value of 8.13 indicates that Oracon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Oracon. Following Lipinski's Rule of Five, Oracon has 3 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 Oracon?
The CAS number of Oracon is 8015-19-8.
What is the molecular formula of Oracon?
The molecular formula of Oracon is C43H56O4.
What is the molecular weight of Oracon?
The molecular weight of Oracon is 636.42 g/mol.
Where can I buy Oracon?
You can request a quote for Oracon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oracon?
Yes, KEHONG BIO provides custom synthesis services for Oracon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.