cephaeline

Molecular Formula: C28H38N2O4


InChI: InChI=1/C28H38N2O4/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23/h12-15,17,20,23-24,29,31H,5-11,16H2,1-4H3/t17-,20-,23+,24-/m0/s1

InChIKey: InChIKey=DTGZHCFJNDAHEN-OZEXIGSWBY
SMILES: [H][C@]3(C[C@@]1([H])NCCc2cc(O)c(OC)cc12)C[C@]4([H])N(CCc5cc(OC)c(OC)cc45)C[C@@H]3CC

CAS number 483-17-0

Names:
    Cephaeline
    Cephaelin
    Cephaeline
    cephaeline

Registries:
    PubChem CID 442195
    Beilstein =100615
    CAS 483-17-0 (from NIST)
    ChEBI 3533
    Kegg C09390
    PubChem ID 10298987
    PubChem ID 11581