Elephantoin
TL;DR: Elephantoin (CAS 13017-11-3) is a chemical compound with molecular formula C19H20O7 and molecular weight 360.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,3R,5S,6S,10R,11S)-3-methyl-9-methylidene-8,14-dioxo-4,7,15-trioxatetracyclo[11.2.1.03,5.06,10]hexadec-13(16)-en-11-yl] 2-methylprop-2-enoate
Also Known As: Elephantopin, Elephantoin, RUSTAIYAN A, KST-1A1053, (methyl-methylene-dioxo-[?]yl) 2-methylprop-2-enoate
| Molecular Formula | C19H20O7 |
|---|---|
| Molecular Weight | 360.12 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 91.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.1209 |
| Heavy Atoms | 26 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 13017-11-3 |
|---|---|
| SMILES | CC(=C)C(=O)O[C@H]1CC2=C[C@@H](C[C@@]3([C@@H](O3)[C@@H]4[C@@H]1C(=C)C(=O)O4)C)OC2=O |
| InChIKey | WIQOUTANBFOBPB-PLJDJVMKSA-N |
Product Overview
Elephantoin (CAS 13017-11-3), with molecular formula C19H20O7 and molecular weight 360.12 g/mol. IUPAC: [(1R,3R,5S,6S,10R,11S)-3-methyl-9-methylidene-8,14-dioxo-4,7,15-trioxatetracyclo[11.2.1.03,5.06,10]hexadec-13(16)-en-11-yl] 2-methylprop-2-enoate.
Chemical Property Profile of Elephantoin
Property Insights of Elephantoin
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Elephantoin. The TPSA of 91.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Elephantoin. Following Lipinski's Rule of Five, Elephantoin has 0 hydrogen bond donor(s) and 7 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 Elephantoin?
The CAS number of Elephantoin is 13017-11-3.
What is the molecular formula of Elephantoin?
The molecular formula of Elephantoin is C19H20O7.
What is the molecular weight of Elephantoin?
The molecular weight of Elephantoin is 360.12 g/mol.
Where can I buy Elephantoin?
You can request a quote for Elephantoin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Elephantoin?
Yes, KEHONG BIO provides custom synthesis services for Elephantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.