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Chemical structure of 6'-O-cinnamoylharpagide

GC35170

6'-O-cinnamoylharpagide

Also listed as 6'-O-Cinnamoyl harpagide

6'-O-Cinnamoyl harpagide is an iridoid glycoside isolated from the roots of Scrophularia ningpoensis

ChemicalCAS1245572-24-0MW494.49FormulaC24H30O11
CAS number
1245572-24-0
Molecular weight
494.49
Formula
C24H30O11
Solubility
Soluble in DMSO
InChIKey
KIYJOXJZHKKVBS-PIMRTDLFSA-N
Catalogue number
GC35170
Brand
GLPBIO
Computed properties PubChem CID 134715181 · XLogP -1.2 · TPSA 175 Ų · H-bond donors 6
XLogP
-1.2
TPSA
175 Ų
H-bond donors
6
H-bond acceptors
11
Rotatable bonds
7
Heavy atoms
35

SMILES C[C@@]1(C[C@@H]([C@]2([C@@H]1[C@@H](OC=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(=O)/C=C/C4=CC=CC=C4)O)O)O)O)O)O

Computed descriptors from PubChem (CID 134715181), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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