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Chemical structure of Schisantherin S

GC71937

Schisantherin S

Also known as 3,4,5,14,15,16-hexamethoxy-9,10-dimethyltricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaen-8-one

Schisantherin S is a dibenzocyclooctene-type lignan isolated from the stems of Schisandra chinensis (Kadsura)

ChemicalCAS2230512-49-7MW430.49FormulaC24H30O7
CAS number
2230512-49-7
Molecular weight
430.49
Formula
C24H30O7
InChIKey
MXMZPEXVCSNTFK-UHFFFAOYSA-N
Catalogue number
GC71937
Brand
GLPBIO
Computed properties PubChem CID 14827753 · XLogP 4.5 · TPSA 72.5 Ų · H-bond donors 0
XLogP
4.5
TPSA
72.5 Ų
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
31

SMILES CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3C(=O)C1C)OC)OC)OC)OC)OC)OC

Computed descriptors from PubChem (CID 14827753), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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