CAS 1581276-63-2 appears in our catalog under these names: (3beta,4alpha,16beta,21beta,22alpha)-Olean-12-ene-3,16,21,22,23,28-hexol 21-[(2E)-2-methyl-2-butenoate], ≥98%, ≥98%, 21-O-Tigloylgymnemagenin. Offered by: Chemat, MedChemExpress. Available pack sizes: 10mg, 20mg, 50mg, 100mg, 200mg, Get quote.
[(3R,4R,4aR,5S,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-4,5,10-trihydroxy-4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-3-yl] (E)-2-methylbut-2-enoate (CAS 1581276-63-2) is a chemical compound with the molecular formula C35H56O7 and a molecular weight of 588.8 g/mol. IUPAC name: [(3R,4R,4aR,5S,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-4,5,10-trihydroxy-4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-3-yl] (E)-2-methylbut-2-enoate. InChIKey: ZVFCKHLBNXUAAD-DQGOMBRUSA-N.
| Molecular formula | C35H56O7 |
|---|---|
| Molecular weight | 588.8 g/mol |
| IUPAC name | [(3R,4R,4aR,5S,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-4,5,10-trihydroxy-4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-3-yl] (E)-2-methylbut-2-enoate |
| InChIKey | ZVFCKHLBNXUAAD-DQGOMBRUSA-N |
| SMILES | C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@@]2([C@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@@]5(C)CO)O)C)C)[C@@H]2CC1(C)C)C)O)CO)O |
Computed by PubChem (NCBI)