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CHEBI:207405 - Stachybonoid C

ChEBI IDCHEBI:207405
ChEBI NameStachybonoid C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H32O5
Net Charge0
Average Mass388.504
Monoisotopic Mass388.22497
SMILESC/C(=C/CC[C@@]1(C)C=Cc2c(O)cc(C)c(C=O)c2O1)CC[C@@H](O)C(C)(C)O
InChIInChI=1S/C23H32O5/c1-15(8-9-20(26)22(3,4)27)7-6-11-23(5)12-10-17-19(25)13-16(2)18(14-24)21(17)28-23/h7,10,12-14,20,25-27H,6,8-9,11H2,1-5H3/b15-7-/t20-,23+/m1/s1
InChIKeyCUBOHSIABUSNJM-ALANAOBMSA-N
Species of MetaboliteComponentSourceComments
Stachybotrys (ncbitaxon:74721) - DOI (10.1039/c7ra09859f)
ChEBI Ontology
Outgoing Relation(s)
Stachybonoid C (CHEBI:207405) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(2S)-2-[(Z,7R)-7,8-dihydroxy-4,8-dimethylnon-3-enyl]-5-hydroxy-2,7-dimethylchromene-8-carbaldehyde
Manual XrefsDatabases
62453204ChemSpider