LIPID MAPS

Structure Database (LMSD)

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Common Name

Corbiculaxanthin

Systematic Name

(3S,3'S,4'R,5'R,6'R)-6',7'-didehydro-3,4,3',5-tetrol

Synonyms

LM ID

LMPR01070663

Formula

C₄₀H₅₆O₄

Exact Mass

Calculate m/z

600.41786

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

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Classification

References

Comments

Imported from http://carotenoiddb.jp/

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Corbicula (#45948)

Bivalvia (#6544)

Carotenoids in three species of Corbicula Clams, Corbicula japonica, Corbicula sandai, and Corbicula sp. (Chinese Freshwater Corbicula Clam).,
J Agric Food Chem, 2005

Pubmed ID: 16218688

String Representations

InChiKey (Click to copy)

UWZLPMMHZRFPKY-JLZKEKHISA-N

InChi (Click to copy)

InChI=1S/C40H56O4/c1-28(17-13-19-30(3)21-23-34-32(5)37(43)35(42)27-38(34,6)7)15-11-12-16-29(2)18-14-20-31(4)22-24-36-39(8,9)25-33(41)26-40(36,10)44/h11-23,33,35,37,41-44H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,28-15+,29-16+,30-19+,31-20+/t24-,33-,35-,37+,40+/m0/s1

SMILES (Click to copy)

C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C=C1C(C)(C)C[C@@H](C[C@@]1(C)O)O)/C=C/C=C(\C)/C=C/C1=C(C)[C@H]([C@H](CC1(C)C)O)O