Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-
TL;DR: Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- (CAS 101959-26-6) is a chemical compound with molecular formula C30H48O3 and molecular weight 456.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,6bS,8aR,12aR,14aR,14bR)-8a,11-bis(hydroxymethyl)-4,4,6a,6b,11,14b-hexamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-one
Also Known As: 28,29-Dihydroxyolean-12-en-3-one, Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-, (5xi)-28,29-Dihydroxy-18alpha-olean-12-en-3-one, (6aR,6bS,8aR,12aR,14aR,14bR)-8a,11-bis(hydroxymethyl)-4,4,6a,6b,11,14b-hexamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-one
| Molecular Formula | C30H48O3 |
|---|---|
| Molecular Weight | 456.36 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 456.36035 |
| Heavy Atoms | 33 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 101959-26-6 |
|---|---|
| SMILES | C[C@]12CCC(=O)C(C1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@@H]4CC(CC5)(C)CO)CO)C)C)(C)C |
| InChIKey | UUXDIKCFQJEIMI-KNEPXSPYSA-N |
Product Overview
Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- (CAS 101959-26-6), with molecular formula C30H48O3 and molecular weight 456.36 g/mol. IUPAC: (6aR,6bS,8aR,12aR,14aR,14bR)-8a,11-bis(hydroxymethyl)-4,4,6a,6b,11,14b-hexamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-one.
Chemical Property Profile of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-
Property Insights of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-
The XLogP value of 5.7 indicates that Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- 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 Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-?
The CAS number of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- is 101959-26-6.
What is the molecular formula of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-?
The molecular formula of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- is C30H48O3.
What is the molecular weight of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-?
The molecular weight of Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- is 456.36 g/mol.
Where can I buy Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-?
You can request a quote for Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Olean-12-en-3-one, 28,29-dihydroxy-, (20alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.