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Chemical structure of CDDO-3P-Im

GC39556

CDDO-3P-Im

Also known as (4aR,6aR,6aS,6bR,8aS,12aS,14bS)-4,4,6a,6b,11,11,14b-heptamethyl-3,13-dioxo-8a-(4-pyridin-3-ylimidazole-1-carbonyl)-4a,5,6,6a,7,8,9,10,12,12a-decahydropicene-2-carbonitrile

CDDO-3P-Im is an analogue of CDDO-Imidazolide with chemopreventive effect· CDDO-3P-Im can reduce the size and the severity of the lung tumors in mouse lung cancer model· CDDO-3P-Im is a orally active necroptosis inhibitor that can be used for the research of ischemia/reperfusion (I/R)

ChemicalCAS1883650-95-0MW618.81FormulaC39H46N4O3
CAS number
1883650-95-0
Molecular weight
618.81
Formula
C39H46N4O3
Solubility
DMSO： 250 mg/mL (404·00 mM)
InChIKey
GXKRPLQWYWDFQN-CXUPGZSSSA-N
Catalogue number
GC39556
Brand
GLPBIO
Computed properties PubChem CID 135397766 · XLogP 7.1 · TPSA 106 Ų · H-bond donors 0
XLogP
7.1
TPSA
106 Ų
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
46

SMILES C[C@@]12CC[C@]3(CCC(C[C@H]3[C@H]1C(=O)C=C4[C@]2(CC[C@@H]5[C@@]4(C=C(C(=O)C5(C)C)C#N)C)C)(C)C)C(=O)N6C=C(N=C6)C7=CN=CC=C7

Computed descriptors from PubChem (CID 135397766), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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