Products 80514-14-3

CAS 80514-14-3 appears in our catalog under these names: 7β-(3-Ethyl-cis-crotonoyloxy)-1α-(2-methylbutyryloxy)-3,14-dehydro-Z-notonipetranone, Anti-inflammatory agent 69. Offered by: Biosynth, MedChemExpress. Available pack sizes: 10mg, 5mg, 25mg, 50mg, Get quote.

Structural formula: {0} (CAS {1})

[(1Z,3S,3aR,5R,7S,7aS)-1-ethylidene-3-(2-methylbutanoyloxy)-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate (CAS 80514-14-3) is a chemical compound with the molecular formula C26H38O5 and a molecular weight of 430.6 g/mol. IUPAC name: [(1Z,3S,3aR,5R,7S,7aS)-1-ethylidene-3-(2-methylbutanoyloxy)-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate. InChIKey: XTQQLVJPORCMAK-NMNXYZJCSA-N.

Identity
Molecular formulaC26H38O5
Molecular weight430.6 g/mol
IUPAC name[(1Z,3S,3aR,5R,7S,7aS)-1-ethylidene-3-(2-methylbutanoyloxy)-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate
InChIKeyXTQQLVJPORCMAK-NMNXYZJCSA-N
SMILESCCC(C)C(=O)O[C@H]1[C@@H]2[C@H]([C@@H](C[C@H](C2=C)OC(=O)/C=C(\C)/CC)C(C)C)/C(=C/C)/C1=O

Computed by PubChem (NCBI)