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Chemical structure of Ternatumoside II

GC71401

Ternatumoside II

Also known as 3-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

Ternatumoside II is a flavonoid glycoside that can be isolated from R· crenulata

ChemicalCAS1473419-87-2MW594.52FormulaC27H30O15
CAS number
1473419-87-2
Molecular weight
594.52
Formula
C27H30O15
InChIKey
JAQAIBSNJJWIKR-GTGBIAQCSA-N
Catalogue number
GC71401
Brand
GLPBIO
Computed properties PubChem CID 71531248 · XLogP -0.4 · TPSA 245 Ų · H-bond donors 9
XLogP
-0.4
TPSA
245 Ų
H-bond donors
9
H-bond acceptors
15
Rotatable bonds
6
Heavy atoms
42

SMILES C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

Computed descriptors from PubChem (CID 71531248), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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