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Chemical structure of Saikogenin A

GC31444

Saikogenin A

Also known as (3S,4R,4aR,6aR,6bS,8S,8aS,14aR,14bS)-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicene-3,8-diol

Saikogenin A, extracted from a Chinese herbal plant called Tsai-Fu, is a dipeptidyl peptidase-IV (DPP-IV) inhibitor

ChemicalCAS5092-09-1MW472.7FormulaC30H48O4
CAS number
5092-09-1
Molecular weight
472.7
Formula
C30H48O4
Solubility
DMSO ： 25 mg/mL (52·89 mM; Need ultrasonic)
InChIKey
QGNVMEXLLPGQEV-HSFRRAFJSA-N
Catalogue number
GC31444
Brand
GLPBIO
Computed properties PubChem CID 99651 · XLogP 5.8 · TPSA 80.9 Ų · H-bond donors 4
XLogP
5.8
TPSA
80.9 Ų
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
34

SMILES C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2C=CC4=C5CC(CC[C@@]5([C@H](C[C@]43C)O)CO)(C)C)C)(C)CO)O

Computed descriptors from PubChem (CID 99651), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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