Elisabethatriene
TL;DR: Elisabethatriene (CAS 334499-19-3) 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.
(1R,4S,4aR)-4-methyl-1-[(2S)-6-methylhept-5-en-2-yl]-7-methylidene-2,3,4,4a,5,6-hexahydro-1H-naphthalene
Also Known As: elisabethatriene, J1.427.922I, (1R,4S,4aR)-4-methyl-1-[(2S)-6-methylhept-5-en-2-yl]-7-methylidene-1,2,3,4,4a,5,6,7-octahydronaphthalene, (1R)-1beta-[(1S)-1,5-Dimethyl-4-hexenyl]-4alpha-methyl-7-methylene-1,2,3,4,4aalpha,5,6,7-octahydronaphthalene, (1R,4S,4aR)-4-methyl-1-((2S)-6-methylhept-5-en-2-yl)-7-methylidene-1,2,3,4,4a,5,6,7-octahydronaphthalene
| Molecular Formula | C20H32 |
|---|---|
| Molecular Weight | 272.25 g/mol |
| LogP | 6.3076 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.2504 |
| Heavy Atoms | 20 |
| Complexity | 405.75424 |
Chemical Identifiers
| CAS Number | 334499-19-3 |
|---|---|
| SMILES | C[C@H]1CC[C@@H](C2=CC(=C)CC[C@H]12)[C@@H](C)CCC=C(C)C |
Product Overview
Elisabethatriene (CAS 334499-19-3), with molecular formula C20H32 and molecular weight 272.25 g/mol. IUPAC: (1R,4S,4aR)-4-methyl-1-[(2S)-6-methylhept-5-en-2-yl]-7-methylidene-2,3,4,4a,5,6-hexahydro-1H-naphthalene.
Chemical Property Profile of Elisabethatriene
Property Insights of Elisabethatriene
The XLogP value of 6.3076 indicates that Elisabethatriene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Elisabethatriene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Elisabethatriene 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 Elisabethatriene?
The CAS number of Elisabethatriene is 334499-19-3.
What is the molecular formula of Elisabethatriene?
The molecular formula of Elisabethatriene is C20H32.
What is the molecular weight of Elisabethatriene?
The molecular weight of Elisabethatriene is 272.25 g/mol.
Where can I buy Elisabethatriene?
You can request a quote for Elisabethatriene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Elisabethatriene?
Yes, KEHONG BIO provides custom synthesis services for Elisabethatriene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.