Products 1802-12-6

CAS 1802-12-6 appears in our catalog under these names: Phytolaccagenin, >95% (HPLC), Phytolaccagenin/ 99.47% (existing batch purity), Phytolaccagenin, Phytolaccagenin, 99%, 99%, Phytolaccagenin (Standard). Offered by: TRC, TargetMol, GLPBio, Biosynth, Chemat. Available pack sizes: 10mg, 1mg, 2mg, 20mg, 5mg, 25mg, 50mg, 100mg.

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

Phytolaccagenin is a triterpenoid.

Source: ChEBI

Identity
Molecular formulaC31H48O7
Molecular weight532.7 g/mol
IUPAC name(2S,4aR,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2-methoxycarbonyl-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChIKeyCYJWWQALTIKOAG-FLORRLIPSA-N
SMILESC[C@@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@@H]([C@@H]([C@@]5(C)CO)O)O)C)C)[C@@H]2C1)C)C(=O)O)C(=O)OC

Computed by PubChem (NCBI)