diatoxanthin
Chemical Formula:
C40H54O2
Molecular Weight:
566.865 Daltons
Monoisotopic Mass:
566.4123809776 Daltons
SMILES:
CC(=CC=CC=C(C)C=CC=C(C#CC1(=C(C)CC(O)CC(C)(C)1))C)C=CC=C(C)C=CC2(C(C)(C)CC(O)CC(C)=2)
InChI:
1S/C40H54O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-21,23,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-20693
KEGG:
C19920
PubChem (CID):
6440986
ChemSpider:
4945217