Products 595-15-3

CAS 595-15-3 appears in our catalog under these names: Soyasapogenol B, min. 95 %, 5 mg, Soyasapogenol B/ 99.81% (existing batch purity), Soyasapogenol B, (3β,4β,22β)-Olean-12-ene-3,22,23-triol, 99.81% ,, 99.81% ,, Soyasapogenol B (Standard). Offered by: Roth, TargetMol, Biosynth, Chemat, MedChemExpress. Available pack sizes: 5mg, 1mg, 10mg, 25mg, 50mg, 100mg, 2mg, Get quote.

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

Soyasapogenol B is a pentacyclic triterpenoid that is oleanane containing a double bond between positions 12 and 13 and substituted by hydroxy groups at the 3beta, 22beta and 24-positions. It derives from a hydride of an oleanane.

Source: ChEBI

Identity
Molecular formulaC30H50O3
Molecular weight458.7 g/mol
IUPAC name(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol
InChIKeyYOQAQNKGFOLRGT-UXXABWCISA-N
SMILESC[C@]12CC[C@@H]([C@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(C[C@H]5O)(C)C)C)C)C)(C)CO)O

Computed by PubChem (NCBI)