purvalanol A

Molecular Formula: C₁₉H₂₅ClN₆O

InChI: InChI=1/C19H25ClN6O/c1-11(2)15(9-27)23-19-24-17(22-14-7-5-6-13(20)8-14)16-18(25-19)26(10-21-16)12(3)4/h5-8,10-12,15,27H,9H2,1-4H3,(H2,22,23,24,25)/t15-/m0/s1/f/h22-23H

InChIKey: InChIKey=PMXCMJLOPOFPBT-TZTVINIZDX
SMILES: CC(C)C(CO)NC1=NC2=C(C(=N1)NC3=CC(=CC=C3)Cl)N=CN2C(C)C

Names:
    purvalanol A
    P01
    (2S)-2-[[6-[(3-chlorophenyl)amino]-9-propan-2-yl-purin-2-yl]amino]-3-methyl-butan-1-ol
    2-({6-[(3-CHLOROPHENYL)AMINO]-9-ISOPROPYL-9H-PURIN-2-YL

Registries:
    PubChem CID 456214
    PubChem ID 8149105