Terminology Service for NFDI4Health
JSON

(1'S,5'R)-5'-hydroxyaverantin

Go to external page http://purl.obolibrary.org/obo/CHEBI_71536

A hydroxyanthraquinone that is 1,3,6,8-tetrahydroxy-9,10-anthraquinone bearing a 1,5-dihydroxyhexyl substituent at position 2 (the 1'S,5'R-diastereomer).

Term info

Label

(1'S,5'R)-5'-hydroxyaverantin

Synonyms
  • (1'S,5'R)-5'-hydroxyaverantin
  • 2-[(1S,5R)-1,5-dihydroxyhexyl]-1,3,6,8-tetrahydroxy-9,10-anthraquinone
database cross reference
Subsets

3_STAR

IUPAC NAME
2-[(1S,5R)-1,5-dihydroxyhexyl]-1,3,6,8-tetrahydroxy-9,10-anthraquinone [ IUPAC ]

charge

0

formula

C20H20O8

has obo namespace

chebi_ontology

id

CHEBI:71536

inchi

InChI=1S/C20H20O8/c1-8(21)3-2-4-12(23)17-14(25)7-11-16(20(17)28)19(27)15-10(18(11)26)5-9(22)6-13(15)24/h5-8,12,21-25,28H,2-4H2,1H3/t8-,12+/m1/s1

inchikey

GGNDESPZSKTNHV-PELKAZGASA-N

mass

388.36800

monoisotopicmass

388.11582

smiles

C[C@@H](O)CCC[C@H](O)c1c(O)cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c1O