LIPID MAPS

Structure Database (LMSD)

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Common Name

2,2'-Dihydroxycanthaxanthin

Systematic Name

(2R,2'R)-2,2'-Dihydroxy-β,β-carotene-4,4'-dione

Synonyms

LM ID

LMPR01070811

Formula

C₄₀H₅₂O₄

Exact Mass

Calculate m/z

596.38656

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

UWWXORBDIRGAHF-VKJKSYSSSA-N

InChi (Click to copy)

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

SMILES (Click to copy)

[C@@H]1(O)C(C)(C)C(/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C)C(=O)C[C@H](O)C2(C)C)=C(C)C(=O)C1

References

Comments

Imported from http://carotenoiddb.jp/

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

synthetic construct (#32630)

Elucidation of a carotenoid biosynthesis gene cluster encoding a novel enzyme, 2,2'-beta-hydroxylase, from Brevundimonas sp. strain SD212 and combinatorial biosynthesis of new or rare xanthophylls.,
Appl Environ Microbiol, 2005

Pubmed ID: 16085816