5,15-Diacetyl-3-benzoyllathyrol [M+H]+
TL;DR: 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ (CAS 218916-52-0) is a chemical compound with molecular formula C31H38O7 and molecular weight 522.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3E)-1,11-diacetyloxy-3,6,6,14-tetramethyl-10-methylidene-2-oxo-13-tricyclo[10.3.0.05,7]pentadec-3-enyl] benzoate
Also Known As: Euphorbia factor L3, 5,15-Diacetyl-3-benzoyllathyrol [M+H]+, 5,15-Diacetyl-3-benzoyllathyrol; Euphorbia factor L3, (2R*,3S*,4R*, 5R*,9S*,11S*,15R*)-5,15-Diacetoxy-3-benzoyloxy-14-oxolathyra-6(17),12E-diene, (E)-7-(benzoyloxy)-1,1,3,6-tetramethyl-9-methylene-4-oxo-1,1a,4,5,6,7,7a,8,9,10,11,11a-dodecahydro-4aH-cyclopenta[a]cyclopropa[f][11]annulene-4a,8-diyl diacetate
| Molecular Formula | C31H38O7 |
|---|---|
| Molecular Weight | 522.26 g/mol |
| LogP | 5.2392 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 522.2618 |
| Heavy Atoms | 38 |
| Complexity | 1179.8682 |
Chemical Identifiers
| CAS Number | 218916-52-0 |
|---|---|
| SMILES | CC1CC2(C(C1OC(=O)C3=CC=CC=C3)C(C(=C)CCC4C(C4(C)C)/C=C(/C2=O)\C)OC(=O)C)OC(=O)C |
Product Overview
5,15-Diacetyl-3-benzoyllathyrol [M+H]+ (CAS 218916-52-0), with molecular formula C31H38O7 and molecular weight 522.26 g/mol. IUPAC: [(3E)-1,11-diacetyloxy-3,6,6,14-tetramethyl-10-methylidene-2-oxo-13-tricyclo[10.3.0.05,7]pentadec-3-enyl] benzoate.
Chemical Property Profile of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+
Property Insights of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+
The XLogP value of 5.2392 indicates that 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,15-Diacetyl-3-benzoyllathyrol [M+H]+. Following Lipinski's Rule of Five, 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+?
The CAS number of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ is 218916-52-0.
What is the molecular formula of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+?
The molecular formula of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ is C31H38O7.
What is the molecular weight of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+?
The molecular weight of 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ is 522.26 g/mol.
Where can I buy 5,15-Diacetyl-3-benzoyllathyrol [M+H]+?
You can request a quote for 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,15-Diacetyl-3-benzoyllathyrol [M+H]+?
Yes, KEHONG BIO provides custom synthesis services for 5,15-Diacetyl-3-benzoyllathyrol [M+H]+ and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.