12alpha-12-Hydroxy-7,13-abietadien-18-oic acid
TL;DR: 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid (CAS 3484-61-5) is a chemical compound with molecular formula C20H30O3 and molecular weight 318.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid
Also Known As: 12-Hydroxyabietic acid, MEGxp0_002045, 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid, 6-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid, 6-hydroxy-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylic acid
| Molecular Formula | C20H30O3 |
|---|---|
| Molecular Weight | 318.22 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.21948 |
| Heavy Atoms | 23 |
| Complexity | 573.0 |
Chemical Identifiers
| CAS Number | 3484-61-5 |
|---|---|
| SMILES | CC(C)C1=CC2=CCC3C(C2CC1O)(CCCC3(C)C(=O)O)C |
| InChIKey | DYNISIGUMYFVJW-UHFFFAOYSA-N |
Product Overview
12alpha-12-Hydroxy-7,13-abietadien-18-oic acid (CAS 3484-61-5), with molecular formula C20H30O3 and molecular weight 318.22 g/mol. IUPAC: 6-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid.
Chemical Property Profile of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid
Property Insights of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid
The XLogP value of 3.5 indicates that 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid?
The CAS number of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid is 3484-61-5.
What is the molecular formula of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid?
The molecular formula of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid is C20H30O3.
What is the molecular weight of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid?
The molecular weight of 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid is 318.22 g/mol.
Where can I buy 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid?
You can request a quote for 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid?
Yes, KEHONG BIO provides custom synthesis services for 12alpha-12-Hydroxy-7,13-abietadien-18-oic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.