Katononic acid
TL;DR: Katononic acid (CAS 76094-29-6) is a chemical compound with molecular formula C30H46O3 and molecular weight 454.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-2-carboxylic acid
Also Known As: Katononic acid, 3-oxo-12-oleanen-29-oic acid, 3-Oxoolean-12-en-29-oic acid, 3-Oxo-olean-12-en-29-oic acid, 2,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-2-carboxylic acid
| Molecular Formula | C30H46O3 |
|---|---|
| Molecular Weight | 454.34 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 454.3447 |
| Heavy Atoms | 33 |
| Complexity | 931.0 |
Chemical Identifiers
| CAS Number | 76094-29-6 |
|---|---|
| SMILES | CC1(C2CCC3(C(C2(CCC1=O)C)CC=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C |
| InChIKey | CGZZFWMLSVHLFZ-UHFFFAOYSA-N |
Product Overview
Katononic acid (CAS 76094-29-6), with molecular formula C30H46O3 and molecular weight 454.34 g/mol. IUPAC: 2,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-2-carboxylic acid.
Chemical Property Profile of Katononic acid
Property Insights of Katononic acid
The XLogP value of 7.2 indicates that Katononic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Katononic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Katononic acid has 1 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 Katononic acid?
The CAS number of Katononic acid is 76094-29-6.
What is the molecular formula of Katononic acid?
The molecular formula of Katononic acid is C30H46O3.
What is the molecular weight of Katononic acid?
The molecular weight of Katononic acid is 454.34 g/mol.
Where can I buy Katononic acid?
You can request a quote for Katononic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Katononic acid?
Yes, KEHONG BIO provides custom synthesis services for Katononic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.