carboxy-fusarin C
Chemical Formula:
C22H26NO7
Molecular Weight:
416.45 Daltons
Monoisotopic Mass:
417.1787522266 Daltons
SMILES:
CC=C(C(=O)[O-])C=C(C)C=C(C=CC=C(C(=O)C12(OC(C(O)(CCO)NC(=O)1)2))C)C
InChI:
1S/C22H27NO7/c1-5-16(18(26)27)12-14(3)11-13(2)7-6-8-15(4)17(25)22-19(30-22)21(29,9-10-24)23-20(22)28/h5-8,11-12,19,24,29H,9-10H2,1-4H3,(H,23,28)(H,26,27)/p-1/b7-6+,13-11+,14-12+,15-8+,16-5+/t19-,21-,22-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-18055
PubChem (CID):
91819749
MetaNetX:
MNXM148124