Actinobolin

Molecular Formula: C₁₃H₂₀N₂O₆

InChI: InChI=1/C13H20N2O6/c1-4(14)12(19)15-10-5(2)21-13(20)8-6(16)3-7(17)11(18)9(8)10/h4-5,7,9-11,17-18,20H,3,14H2,1-2H3,(H,15,19)/t4-,5+,7+,9+,10-,11-/m0/s1/f/h15H

InChIKey: InChIKey=NPKNAURWRZGCTC-OMJFVACZDF
SMILES: CC1C(C2C(C(CC(=O)C2=C(O1)O)O)O)NC(=O)C(C)N

Names:
    Actinobolin
    Isocoumarin, 4- (2-aminopropionamido)-3, 4,4a,5,6,7-hexahydro-5,6,8-trihydroxy-3-methyl-
    NSC31083
    Propanamide, 2-amino-N- (3,4,4a,5,6,7-hexahydro-5,6, 8-trihydroxy-3-methyl-1-oxo-1H-2-benzopyran-4-yl)-, [3R-[3.alpha., 4.alpha.(S*),4a.beta.,5.beta.,6.alpha.]]-
    Propanamide, 2-amino-N-(3,4,4a,5,6,7-hexahydro-5,6, 8-trihydroxy-3-methyl-1-oxo-1H-2-benzopyran-4-yl)-
    (2S)-2-amino-N-[(3R,4R,4aR,5R,6R)-1,5,6-trihydroxy-3-methyl-8-oxo-3,4,4a,5,6,7-hexahydroisochromen-4-yl]propanamide
    24397-89-5

Registries:
    PubChem CID 233022
    PubChem ID 90139