lutein

Chemical Formula:

C₄₀H₅₆O₂

Molecular Weight:

568.881 Daltons

Monoisotopic Mass:

568.4280310418 Daltons

SMILES:

CC(C=CC=C(C)C=CC1(C(C)(C)CC(O)C=C(C)1))=CC=CC=C(C)C=CC=C(C)C=CC2(C(C)(C)CC(O)CC(C)=2)

InChI:

1S/C40H56O2/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/h11-25,35-37,41-42H,26-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36+,37-/m0/s1

InChIKey:

KBPHJBAIARWVSC-RGZFRNHPSA-N

Synonyms

(3R,3'R)-dihydroxy-α-carotene
(3R,3'R,6'R)-β,ε-carotene-3,3'-diol

Databases

MetaCyc: CPD1F-119

PubChem (CID): 5281243

MetaboLights: MTBLC28838

DRUGBANK: DB00137

HMDB: HMDB03233

LIPID MAPS: LMPR01070274

ChEBI: 28838

KEGG: C08601

Seed: cpd05508

MetaNetX: MNXM4660