vobtusine

Molecular Formula: C₄₃H₅₀N₄O₆

InChI: InChI=1/C43H50N4O6/c1-50-30-9-5-7-28-32(30)47-24-38(20-25-21-39-13-18-52-31(39)10-15-45-17-12-42(28,36(39)45)43(25,47)49)23-46-16-11-41-27-6-3-4-8-29(27)44-33(41)26(34(48)51-2)22-40(35(41)46)14-19-53-37(38)40/h3-9,25,31,35-37,44,49H,10-24H2,1-2H3/t25-,31+,35+,36+,37+,38+,39-,40+,41+,42-,43-/m1/s1

InChIKey: InChIKey=IIMPGJMHQMBXKL-OPDPKHDKBD
SMILES: [H][C@@]12C[C@]3(CN4CC[C@@]56C(Nc7ccccc57)=C(C[C@@]8(CCO[C@@]38[H])[C@]46[H])C(=O)OC)CN9c%10c(OC)cccc%10[C@@]%11(CCN%12CC[C@]%13([H])OCC[C@]%13(C1)[C@@]%11%12[H])[C@]29O

CAS number 19772-79-3

Names:
    CHEBI:10016
    Vobtusine
    vobtusine
    19772-79-3

Registries:
    PubChem CID 73534
    Beilstein =4641215
    Beilstein =77486
    CAS 19772-79-3 (from NIST)
    ChEBI 10016
    Kegg C09254
    PubChem ID 11445
    PubChem ID 14718131