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Chemical structure of 17-Hydroxyisolathyrol

GC35060

17-Hydroxyisolathyrol

Also known as (3Z,9Z)-1,11,13-trihydroxy-10-(hydroxymethyl)-3,6,6,14-tetramethyltricyclo[10.3.0.05,7]pentadeca-3,9-dien-2-one

17-Hydroxyisolathyrol is a macrocychc lathyrol derivative isolated from seeds of Euphorbla luthyrrs

ChemicalCAS93551-00-9MW350.45FormulaC20H30O5
CAS number
93551-00-9
Molecular weight
350.45
Formula
C20H30O5
Solubility
DMSO : 100 mg/mL (285·35 mM; Need ultrasonic)
InChIKey
XKXYJTIBKZGIPR-YDYNUCMUSA-N
Catalogue number
GC35060
Brand
GLPBIO
Computed properties PubChem CID 127256191 · XLogP 1.2 · TPSA 98 Ų · H-bond donors 4
XLogP
1.2
TPSA
98 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
25

SMILES CC1CC2(C(C1O)C(/C(=C\CC3C(C3(C)C)/C=C(\C2=O)/C)/CO)O)O

Computed descriptors from PubChem (CID 127256191), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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