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CHEBI:211074 - Colletochlorin H

ChEBI IDCHEBI:211074
ChEBI NameColletochlorin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H15ClO3
Net Charge0
Average Mass242.702
Monoisotopic Mass242.07097
SMILESCc1cc(O)c2c(c1Cl)C(C)(C)O[C@H](O)C2
InChIInChI=1S/C12H15ClO3/c1-6-4-8(14)7-5-9(15)16-12(2,3)10(7)11(6)13/h4,9,14-15H,5H2,1-3H3/t9-/m0/s1
InChIKeyNBSARYVOSBQHCS-VIFPVBQESA-N
Species of MetaboliteComponentSourceComments
Colletotrichum higginsianum (ncbitaxon:80884) - DOI (10.1016/j.tet.2017.10.018)
ChEBI Ontology
Outgoing Relation(s)
Colletochlorin H (CHEBI:211074) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
8-chloro-1,1,7-trimethyl-3,4-dihydroisochromene-3,5-diol
Manual XrefsDatabases
78435261ChemSpider