LIPID MAPS

Structure Database (LMSD)

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Common Name

3,4,3',4'-Tetrahydrobisanhydrobacterioruberin

Systematic Name

(2R,2'R)-Bis-(3-methylbut-2-enyl)-1,2,1',2'-tetrahydro-psi,psi-carotene-1,1'-diol

Synonyms

LM ID

LMPR01080028

Formula

C₅₀H₇₆O₂

Exact Mass

Calculate m/z

708.58453

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

YDHWOAQKEXVUAU-DRYHAIIPSA-N

InChi (Click to copy)

InChI=1S/C50H76O2/c1-39(2)31-35-47(49(11,12)51)37-33-45(9)29-19-27-43(7)25-17-23-41(5)21-15-16-22-42(6)24-18-26-44(8)28-20-30-46(10)34-38-48(50(13,14)52)36-32-40(3)4/h15-32,47-48,51-52H,33-38H2,1-14H3/b16-15+,23-17+,24-18+,27-19+,28-20+,41-21+,42-22+,43-25+,44-26+,45-29+,46-30+/t47-,48-/m0/s1

SMILES (Click to copy)

C(=C(/C)\CC[C@H](C/C=C(/C)\C)C(C)(C)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)/CC[C@H](C/C=C(/C)\C)C(C)(O)C

References

Comments

Imported from http://carotenoiddb.jp/

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Haloarcula japonica (#29282)

Halobacteria (#183963)

Complete biosynthetic pathway of the C50 carotenoid bacterioruberin from lycopene in the extremely halophilic archaeon Haloarcula japonica.,
J Bacteriol, 2015

Pubmed ID: 25712483