Abieta-7,13-diene
TL;DR: Abieta-7,13-diene (CAS 35241-40-8) is a chemical compound with molecular formula C20H32 and molecular weight 272.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aS,4bR,10aS)-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene
Also Known As: Abietadiene, abieta-7,13-diene, (-)-Abietadiene, 7,13-Abietadiene, syn-abeita-7,13-diene
| Molecular Formula | C20H32 |
|---|---|
| Molecular Weight | 272.25 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.2504 |
| Heavy Atoms | 20 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 35241-40-8 |
|---|---|
| SMILES | CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCCC3(C)C)C |
| InChIKey | BBPXZLJCPUPNGH-CMKODMSKSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Abieta-7,13-diene (CAS 35241-40-8), with molecular formula C20H32 and molecular weight 272.25 g/mol. IUPAC: (4aS,4bR,10aS)-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene.
Chemical Property Profile of Abieta-7,13-diene
Property Insights of Abieta-7,13-diene
The XLogP value of 6.3 indicates that Abieta-7,13-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Abieta-7,13-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Abieta-7,13-diene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Abieta-7,13-diene?
The CAS number of Abieta-7,13-diene is 35241-40-8.
What is the molecular formula of Abieta-7,13-diene?
The molecular formula of Abieta-7,13-diene is C20H32.
What is the molecular weight of Abieta-7,13-diene?
The molecular weight of Abieta-7,13-diene is 272.25 g/mol.
Where can I buy Abieta-7,13-diene?
You can request a quote for Abieta-7,13-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Abieta-7,13-diene?
Yes, KEHONG BIO provides custom synthesis services for Abieta-7,13-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.