3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester
TL;DR: 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester (CAS 35137-30-5) is a chemical compound with molecular formula C31H49NO3 and molecular weight 483.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (4aS,6aR,6aS,6bR,8aR,12aR,14bS)-10-hydroxyimino-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate
Also Known As: 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester
| Molecular Formula | C31H49NO3 |
|---|---|
| Molecular Weight | 483.37 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 483.37125 |
| Heavy Atoms | 35 |
| Complexity | 978.0 |
Chemical Identifiers
| CAS Number | 35137-30-5 |
|---|---|
| SMILES | C[C@]12CCC(=NO)C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)OC)C)C)(C)C |
| InChIKey | OQNODWYKFOWXLK-VNNAKPRGSA-N |
Product Overview
3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester (CAS 35137-30-5), with molecular formula C31H49NO3 and molecular weight 483.37 g/mol. IUPAC: methyl (4aS,6aR,6aS,6bR,8aR,12aR,14bS)-10-hydroxyimino-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate.
Chemical Property Profile of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester
Property Insights of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester
The XLogP value of 7.8 indicates that 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester has 1 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 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester?
The CAS number of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester is 35137-30-5.
What is the molecular formula of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester?
The molecular formula of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester is C31H49NO3.
What is the molecular weight of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester?
The molecular weight of 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester is 483.37 g/mol.
Where can I buy 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester?
You can request a quote for 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-(Hydroxyimino)-olean-12-en-28-oic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.