crocetin
Chemical Formula:
C20H22O4
Molecular Weight:
326.391 Daltons
Monoisotopic Mass:
328.16745925879997 Daltons
SMILES:
CC(=CC=CC=C(C)C=CC=C(C)C(=O)[O-])C=CC=C(C)C(=O)[O-]
InChI:
1S/C20H24O4/c1-15(11-7-13-17(3)19(21)22)9-5-6-10-16(2)12-8-14-18(4)20(23)24/h5-14H,1-4H3,(H,21,22)(H,23,24)/p-2/b6-5+,11-7+,12-8+,15-9+,16-10+,17-13+,18-14+
InChIKey:
Databases
MetaCyc:
CPD-8662
ChEBI:
62767
PubChem (CID):
25244519
KEGG:
C08588
Seed:
cpd05495
MetaNetX:
MNXM3952