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CHEBI:71534 - (S)-averantin

Default Structure
ChEBI IDCHEBI:71534
ChEBI Name(S)-averantin
Stars
ASCII Name(S)-averantin
DefinitionAn optically active form of averantin having S-configuration.
Last Modified11 June 2014
SubmitterKAX
DownloadsMolfile
FormulaC20H20O7
Net Charge0
Average Mass372.373
Monoisotopic Mass372.12090
SMILESCCCCC[C@H](O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C20H20O7/c1-2-3-4-5-12(22)17-14(24)8-11-16(20(17)27)19(26)15-10(18(11)25)6-9(21)7-13(15)23/h6-8,12,21-24,27H,2-5H2,1H3/t12-/m0/s1
InChIKeyWGPOPPKSQRZUTP-LBPRGKRZSA-N
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
(S)-averantin (CHEBI:71534) is a averantin (CHEBI:64522)
(S)-averantin (CHEBI:71534) is conjugate acid of (S)-averantin(1−) (CHEBI:77899)
Incoming Relation(s)
(S)-averantin(1−) (CHEBI:77899) is conjugate base of (S)-averantin (CHEBI:71534)
IUPAC Name 
1,3,6,8-tetrahydroxy-2-[(1S)-1-hydroxyhexyl]-9,10-anthraquinone
Synonyms  Source
(1'S)-averantinSUBMITTER
(S)-(−)-averantinChEBI
Manual XrefsDatabases
CPD-10163MetaCyc
Registry NumbersSources
Reaxys:4570143Reaxys
Citations