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Chemical structure of Gambogenic acid

GC38062

Gambogenic acid

Also known as (Z)-4-[(1S,2S,13S,15R)-7-[(2E)-3,7-dimethylocta-2,6-dienyl]-6,8-dihydroxy-17,17-dimethyl-5-(3-methylbut-2-enyl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.1.02,11.02,15.04,9]octadeca-4,6,8,11-tetraen-15-yl]-2-methylbut-2-enoic acid

Gambogenic acid is an active ingredient in gamboge, with anticancer activity· Gambogenic acid acts as an effective inhibitor of EZH2, specifically and covalently binds to Cys668 within the EZH2-SET domain, and induces EZH2 ubiquitination

ChemicalCAS173932-75-7MW630.77FormulaC38H46O8
CAS number
173932-75-7
Molecular weight
630.77
Formula
C38H46O8
Solubility
DMSO： 250 mg/mL (396·34 mM)
InChIKey
RCWNBHCZYXWDOV-VSFMGBBVSA-N
Catalogue number
GC38062
Brand
GLPBIO
Computed properties PubChem CID 10794070 · XLogP 7.9 · TPSA 130 Ų · H-bond donors 3
XLogP
7.9
TPSA
130 Ų
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
46

SMILES CC(=CCC/C(=C/CC1=C(C(=C2C(=C1O)C(=O)C3=C[C@@H]4C[C@@H]5[C@@]3(O2)[C@](C4=O)(OC5(C)C)C/C=C(/C)\C(=O)O)CC=C(C)C)O)/C)C

Computed descriptors from PubChem (CID 10794070), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
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