senecionine
InChI:
InChI=1/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-/m1/s1
InChIKey:
InChIKey=HKODIGSRFALUTA-JTLQZVBZBZ
SMILES:
[H]\C(C)=C1/C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@]([H])(OC1=O)[C@@]23[H]
CAS number 130-01-8
Names:
aureine
Senecionine
Senecionin
Senecionine
senecionine
Registries:
PubChem CID 5280906
Beilstein =8162955
Beilstein =934445
Beilstein =94450
CAS 130-01-8 (from NIST)
ChEBI 9107
Kegg C06176
PubChem ID 8427