LIPID MAPS

Structure Database (LMSD)

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Common Name

3-Hydroxy-4-ketotorulene

Systematic Name

3-Hydroxy-3',4'-didehydro-β,psi-caroten-4-one

Synonyms

(3R)-3-Hydroxy-4-ketotorulene

LM ID

LMPR01070565

Formula

C₄₀H₅₂O₂

Exact Mass

Calculate m/z

564.39673

Status

Active

Show lipids differing only in stereochemistry/bond geometry

Main

Classification

String Representations

InChiKey (Click to copy)

JQSLJBXSPJMQQS-QWXYTXGVSA-N

InChi (Click to copy)

InChI=1S/C40H52O2/c1-30(2)17-13-20-33(5)23-15-25-34(6)24-14-21-31(3)18-11-12-19-32(4)22-16-26-35(7)27-28-37-36(8)39(42)38(41)29-40(37,9)10/h11-28,38,41H,29H2,1-10H3/b12-11+,20-13+,21-14+,22-16+,25-15+,28-27+,31-18+,32-19+,33-23+,34-24+,35-26+/t38-/m1/s1

SMILES (Click to copy)

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

References

Comments

Imported from http://carotenoiddb.jp/

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Phaffia rhodozyma (#264483)

Tremellomycetes (#155616)

Characterization and singlet oxygen quenching activity of (3R)-3-hydroxy-4-ketotorulene and (3R)-3-hydroxy-4-keto-γ-carotene isolated from the yeast Xanthophyllomyces dendrorhrous.,
J Oleo Sci, 2012

Pubmed ID: 22790171