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CHEBI:217382 - ICM0201

ChEBI IDCHEBI:217382
ChEBI NameICM0201
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H13NO6
Net Charge0
Average Mass267.237
Monoisotopic Mass267.07429
SMILESO=C(O)c1cccc2c1N[C@@H]1OC[C@@H](O)CC1(O)O2
InChIInChI=1S/C12H13NO6/c14-6-4-12(17)11(18-5-6)13-9-7(10(15)16)2-1-3-8(9)19-12/h1-3,6,11,13-14,17H,4-5H2,(H,15,16)/t6-,11+,12?/m0/s1
InChIKeySKFNUBZVZUFBSE-JSPAPJHSSA-N
Species of MetaboliteComponentSourceComments
Cunninghamella (ncbitaxon:4852) - PubMed (12760675)
ChEBI Ontology
Outgoing Relation(s)
ICM0201 (CHEBI:217382) is a benzoxazine (CHEBI:46969)
IUPAC Name 
(3S,10aR)-3,4a-dihydroxy-3,4,10,10a-tetrahydro-2H-pyrano[3,2-b][1,4]benzoxazine-9-carboxylic acid
Manual XrefsDatabases
7989726ChemSpider