Products 151636-93-0

CAS 151636-93-0 appears in our catalog under these names: 19-Hydroxybaccatin V, 19-Hydroxybaccatin V, ≥95%. Offered by: MedChemExpress, Chemat. Available pack sizes: Get quote, 5mg.

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

[(1S,2S,3R,4S,7R,9R,10R,12R,15S)-4,12-diacetyloxy-1,9,15-trihydroxy-10-(hydroxymethyl)-14,17,17-trimethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate (CAS 151636-93-0) is a chemical compound with the molecular formula C31H38O12 and a molecular weight of 602.6 g/mol. IUPAC name: [(1S,2S,3R,4S,7R,9R,10R,12R,15S)-4,12-diacetyloxy-1,9,15-trihydroxy-10-(hydroxymethyl)-14,17,17-trimethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate. InChIKey: SYDMVWLQJZBPIU-QZDKRUOYSA-N.

Identity
Molecular formulaC31H38O12
Molecular weight602.6 g/mol
IUPAC name[(1S,2S,3R,4S,7R,9R,10R,12R,15S)-4,12-diacetyloxy-1,9,15-trihydroxy-10-(hydroxymethyl)-14,17,17-trimethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
InChIKeySYDMVWLQJZBPIU-QZDKRUOYSA-N
SMILESCC1=C2[C@H](C(=O)[C@@]3([C@@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)CO)OC(=O)C

Computed by PubChem (NCBI)