Products 2468035-31-4

CAS 2468035-31-4 is the registry number for BChE-IN-9. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

[(1R,2S,5S,8S,10R,14R,15R,21R)-1,2,5,8,15,20,20-heptamethyl-19-azapentacyclo[12.9.0.02,11.05,10.015,21]tricos-11-en-8-yl]methanol (CAS 2468035-31-4) is a chemical compound with the molecular formula C30H51NO and a molecular weight of 441.7 g/mol. IUPAC name: [(1R,2S,5S,8S,10R,14R,15R,21R)-1,2,5,8,15,20,20-heptamethyl-19-azapentacyclo[12.9.0.02,11.05,10.015,21]tricos-11-en-8-yl]methanol. InChIKey: HFULOZRUEGOFNH-DWJKITPBSA-N.

Identity
Molecular formulaC30H51NO
Molecular weight441.7 g/mol
IUPAC name[(1R,2S,5S,8S,10R,14R,15R,21R)-1,2,5,8,15,20,20-heptamethyl-19-azapentacyclo[12.9.0.02,11.05,10.015,21]tricos-11-en-8-yl]methanol
InChIKeyHFULOZRUEGOFNH-DWJKITPBSA-N
SMILESC[C@]12CC[C@](C[C@H]1C3=CC[C@@H]4[C@]5(CCCNC([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)C)(C)CO

Computed by PubChem (NCBI)

Synonyms: BChE-IN-9, orb1687479