Callystatin A

Molecular Formula: C29H44O4


InChI: InChI=1/C29H44O4/c1-8-22(5)28(31)24(7)29(32)23(6)18-20(3)12-10-13-21(4)19-25(9-2)16-17-26-14-11-15-27(30)33-26/h10-12,15-19,21-24,26,28,31H,8-9,13-14H2,1-7H3/b12-10+,17-16+,20-18+,25-19-/t21-,22+,23-,24+,26-,28-/m1/s1

InChIKey: InChIKey=QPJTWGLLJWBDQW-KMMMXHTBBM
SMILES: CCC(C)C(C(C)C(=O)C(C)C=C(C)C=CCC(C)C=C(CC)C=CC1CC=CC(=O)O1)O

Names:
    AIDS-123605
    AIDS123605
    Callystatin A
    (6R)-6-[(1E,3Z,5R,7E,9E,11R,13S,14R,15S)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-heptadeca-1,3,7,9-tetraenyl]-5,6-dihydropyran-2-one
    189883-16-7
    2H-Pyran-2-one, 6-[(1E,3Z,5R,7E,9E,11R,13S,14R,15S)-3-ethyl-14-hydroxy-5,9,11,13,15-pentamethyl-12-oxo-1,3,7,9-heptadecatetraenyl]-5,6-dihydro-, (6R)-

Registries:
    PubChem CID 5471086
    PubChem ID 219733