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Chemical structure of Cucurbitacin Q1

GC65063

Cucurbitacin Q1

Also known as [(E,6R)-6-hydroxy-2-methyl-5-oxo-6-[(2S,3S,8S,9R,10R,13R,14S,16R,17R)-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-3-en-2-yl] acetate

Cucurbitacin Q1 is a tetracyclic triterpene that can be found in Cucumis prophetarum

ChemicalCAS99530-82-2MW560.72FormulaC32H48O8
CAS number
99530-82-2
Molecular weight
560.72
Formula
C32H48O8
InChIKey
LMJMTWXDWFWZHV-OBTWUPKTSA-N
Catalogue number
GC65063
Brand
GLPBIO
Computed properties PubChem CID 14165733 · XLogP 2.5 · TPSA 141 Ų · H-bond donors 4
XLogP
2.5
TPSA
141 Ų
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
40

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

Computed descriptors from PubChem (CID 14165733), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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