Mucronine B

Molecular Formula: C28H36N4O4


InChI: InChI=1/C28H36N4O4/c1-5-18(2)25-28(35)31-23(16-19-9-7-6-8-10-19)26(33)30-14-13-20-11-12-24(36-4)21(15-20)17-22(29-3)27(34)32-25/h6-15,18,22-23,25,29H,5,16-17H2,1-4H3,(H,30,33)(H,31,35)(H,32,34)/b14-13-/t18-,22-,23-,25-/m0/s1/f/h30-32H

InChIKey: InChIKey=HBLUGHSSFJXCOA-LKUXJLJODS
SMILES: CCC(C)C1C(=O)NC(C(=O)NC=CC2=CC(=C(C=C2)OC)CC(C(=O)N1)NC)CC3=CC=CC=C3

Names:
    C10010
    Mucronine B
    (3S,6S,9S,12Z)-9-benzyl-6-[(2S)-butan-2-yl]-17-methoxy-3-methylamino-5,8,11-triazabicyclo[12.3.1]octadeca-12,15,17,19-tetraene-4,7,10-trione
    38840-26-5

Registries:
    PubChem CID 5281593
    PubChem ID 12196