Lup-20(29)-en-3beta-yl 3-phenylprop-2-enoate
[(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] 3-phenylprop-2-enoate
Also Known As: Lup-20(29)-en-3beta-yl 3-phenylprop-2-enoate|Lup-20(29)-en-3-ol, 3-(3-phenyl-2-propenoate), (3beta)-|Lup-20(29)-en-3-ol, 3-(3-phenyl-2-propenoate), (3I(2))-
| Molecular Formula | C39H56O2 |
|---|---|
| Molecular Weight | 556.42804 g/mol |
| LogP | 12.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 556.42804 |
| Monoisotopic Mass | 556.42804 |
| Heavy Atoms | 41 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 65883-50-3 |
|---|---|
| SMILES | CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)OC(=O)C=CC6=CC=CC=C6)C)C |
| InChIKey | HHCSYPMWJQHCMZ-HBHILWERSA-N |
Product Overview
Lup-20(29)-en-3beta-yl 3-phenylprop-2-enoate (CAS 65883-50-3), with molecular formula C39H56O2 and molecular weight 556.42804 g/mol. IUPAC: [(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] 3-phenylprop-2-enoate.
Lup-20(29)-en-3beta-yl 3-phenylprop-2-enoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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