(S)-autumnaline
Chemical Formula:
C21H27NO5
Molecular Weight:
373.448 Daltons
Monoisotopic Mass:
373.1889229824 Daltons
SMILES:
CN2(CCC3(=CC(OC)=C(O)C=C([CH](CCC1(C=C(O)C(OC)=C(OC)C=1))2)3))
InChI:
1S/C21H27NO5/c1-22-8-7-14-11-19(25-2)17(23)12-15(14)16(22)6-5-13-9-18(24)21(27-4)20(10-13)26-3/h9-12,16,23-24H,5-8H2,1-4H3/t16-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-9790
ChEBI:
80672
PubChem (CID):
13878324
KEGG:
C16707
Seed:
cpd16514
MetaNetX:
MNXM13767