2,2'-dihydroxycanthaxanthin
Chemical Formula:
C40H52O4
Molecular Weight:
596.848 Daltons
Monoisotopic Mass:
596.3865601576 Daltons
SMILES:
CC(=CC=CC=C(C=CC=C(C=CC1(C(C(O)CC(C=1C)=O)(C)C))C)C)C=CC=C(C)C=CC2(=C(C(CC(O)C2(C)C)=O)C)
InChI:
1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)35(41)25-37(43)39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)36(42)26-38(44)40(34,9)10/h11-24,37-38,43-44H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t37-,38-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-17661
PubChem (CID):
91820187
MetaNetX:
MNXM147701