SpOx1_000645

Molecular Formula: C39H35N3O7


InChI: InChI=1/C39H35N3O7/c40-36(45)31-33-37(46)49-34(26-14-5-2-6-15-26)32(25-12-3-1-4-13-25)42(33)35(27-16-7-8-17-30(27)48-22-21-44)39(31)28-23-24(11-9-10-20-43)18-19-29(28)41-38(39)47/h1-8,12-19,23,31-35,43-44H,10,20-22H2,(H2,40,45)(H,41,47)/t31-,32-,33-,34+,35+,39-/m0/s1/f/h41H,40H2

InChIKey: InChIKey=NMMZUXMYXVBTFI-RBQPUCDPDZ
SMILES: C1=CC=C(C=C1)C2C(OC(=O)C3N2C(C4(C3C(=O)N)C5=C(C=CC(=C5)C#CCCO)NC4=O)C6=CC=CC=C6OCCO)C7=CC=CC=C7

Names:
    SpOx1_000645
    (2'R,3S,3'S,6'S,7'R,9'S)-5-(4-hydroxybut-1-ynyl)-9'-[2-(2-hydroxyethoxy)phenyl]-2,5'-dioxo-2',3'-diphenyl-spiro[1H-indole-3,8'-4-oxa-1-azabicyclo[4.3.0]nonane]-7'-carboxamide

Registries:
    PubChem CID 6729584
    PubChem ID 11496459