Products 2923907-92-8

CAS 2923907-92-8 is the registry number for GLI1-IN-1. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

[(1S)-1-[(3S,8S,9R,10R,12R,13R,14R,17S)-8,14,17-trihydroxy-10,13-dimethyl-3-[2-(4-methylpiperazin-1-yl)acetyl]oxy-12-[(E)-3-phenylprop-2-enoyl]oxy-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] (2S)-2-methylbutanoate (CAS 2923907-92-8) is a chemical compound with the molecular formula C42H60N2O9 and a molecular weight of 736.9 g/mol. IUPAC name: [(1S)-1-[(3S,8S,9R,10R,12R,13R,14R,17S)-8,14,17-trihydroxy-10,13-dimethyl-3-[2-(4-methylpiperazin-1-yl)acetyl]oxy-12-[(E)-3-phenylprop-2-enoyl]oxy-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] (2S)-2-methylbutanoate. InChIKey: CXELXEUAFXDMTL-GRQLDIHHSA-N.

Identity
Molecular formulaC42H60N2O9
Molecular weight736.9 g/mol
IUPAC name[(1S)-1-[(3S,8S,9R,10R,12R,13R,14R,17S)-8,14,17-trihydroxy-10,13-dimethyl-3-[2-(4-methylpiperazin-1-yl)acetyl]oxy-12-[(E)-3-phenylprop-2-enoyl]oxy-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] (2S)-2-methylbutanoate
InChIKeyCXELXEUAFXDMTL-GRQLDIHHSA-N
SMILESCC[C@H](C)C(=O)O[C@@H](C)[C@@]1(CC[C@]2([C@@]1([C@@H](C[C@H]3[C@]2(CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CN5CCN(CC5)C)C)O)OC(=O)/C=C/C6=CC=CC=C6)C)O)O

Computed by PubChem (NCBI)

Synonyms: orb2566183