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Chemical structure of Soyasapogenol C

GC65198

Soyasapogenol C

Also known as (3S,4S,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,12,12a,14,14a-dodecahydropicen-3-ol

Soyasapogenol C is an oleanane-type triterpenoid

ChemicalCAS595-14-2MW440.7FormulaC30H48O2
CAS number
595-14-2
Molecular weight
440.7
Formula
C30H48O2
InChIKey
VNGUCOGHCJHFID-FLZFTVBESA-N
Catalogue number
GC65198
Brand
GLPBIO
Computed properties PubChem CID 3083637 · XLogP 8.2 · TPSA 40.5 Ų · H-bond donors 2
XLogP
8.2
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
32

SMILES C[C@@]12CC[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]1CC(C=C2)(C)C)C

Computed descriptors from PubChem (CID 3083637), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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