fucoxanthin
Chemical Formula:
C42H58O6
Molecular Weight:
658.917 Daltons
Monoisotopic Mass:
658.4233395944 Daltons
SMILES:
CC(C=CC=C([CH]=C=C1(C(C)(O)CC(OC(=O)C)CC(C)(C)1))C)=CC=CC=C(C)C=CC=C(C)C(=O)CC23(C(C)(C)CC(O)CC(C)(O2)3)
InChI:
1S/C42H58O6/c1-29(18-14-19-31(3)22-23-37-38(6,7)26-35(47-33(5)43)27-40(37,10)46)16-12-13-17-30(2)20-15-21-32(4)36(45)28-42-39(8,9)24-34(44)25-41(42,11)48-42/h12-22,34-35,44,46H,24-28H2,1-11H3/b13-12+,18-14+,20-15+,29-16+,30-17+,31-19+,32-21+/t23?,34-,35-,40+,41+,42-/m0/s1
InChIKey:
Synonyms
- (3'S,5'R,6'R)-3'-acetoxy-5,6-epoxy-3,5'-dihydroxy-6',7'-didehydro-5,6,7,8,5',6'-hexahydro-β,β-caroten-8-one
Databases
MetaCyc:
CPD-20679
PubChem (CID):
5281239
KNApSAcK:
C00003773
KEGG:
C08596
ChEBI:
5186
RefMet:
Fucoxanthin