aurachin B
Chemical Formula:
C25H33NO2
Molecular Weight:
379.541 Daltons
Monoisotopic Mass:
380.2589543408 Daltons
SMILES:
CC(C)=CCCC(C)=CCCC(C)=CCC2(C1(C=CC=CC=1[N+](=C(C)C(O)=2)[O-]))
InChI:
1S/C25H33NO2/c1-18(2)10-8-11-19(3)12-9-13-20(4)16-17-23-22-14-6-7-15-24(22)26(28)21(5)25(23)27/h6-7,10,12,14-16,27H,8-9,11,13,17H2,1-5H3/b19-12+,20-16+
InChIKey:
Databases
MetaCyc:
CPD-15910
ChEBI:
131528
KEGG:
C21140
PubChem (CID):
6439168
MetaNetX:
MNXM148093