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Chemical structure of NSC 12

GC44465

NSC 12

Also known as 4,4,4-trifluoro-1-[(8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-(trifluoromethyl)butane-1,3-diol

NSC 12 is an extracellular trap for fibroblast growth factor 2 (FGF2) that binds FGF2 (Kd = 51 μM) and interferes with its interaction with FGFR1, without affecting the ability of FGF2 to bind heparin or heparin sulfate proteoglycans (HSPGs)

ChemicalCAS102586-30-1MW484.5FormulaC24H34F6O3
CAS number
102586-30-1
Molecular weight
484.5
Formula
C24H34F6O3
Solubility
DMF： 2 mg/ml,DMSO： 0·1 mg/ml,Ethanol： 20 mg/ml,Ethanol：PBS (pH 7·2)(1：2)： 0·33 mg/ml
InChIKey
OHKBOEWLASAFLW-DRPHTYIMSA-N
Catalogue number
GC44465
Brand
GLPBIO
Computed properties PubChem CID 24843124 · XLogP 6 · TPSA 60.7 Ų · H-bond donors 3
XLogP
6
TPSA
60.7 Ų
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
3
Heavy atoms
33

SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(CC(C(F)(F)F)(C(F)(F)F)O)O)CC=C4[C@@]3(CCC(C4)O)C

Computed descriptors from PubChem (CID 24843124), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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