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CHEBI:225319 - (+/-)-Isoalternatine A

ChEBI IDCHEBI:225319
ChEBI Name(+/-)-Isoalternatine A
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SubmitterMetaboLights
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FormulaC14H17NO3
Net Charge0
Average Mass247.294
Monoisotopic Mass247.12084
SMILESC[C@H](O)[C@@H](C)OC(=O)Cc1cnc2ccccc12
InChIInChI=1S/C14H17NO3/c1-9(16)10(2)18-14(17)7-11-8-15-13-6-4-3-5-12(11)13/h3-6,8-10,15-16H,7H2,1-2H3/t9-,10+/m0/s1
InChIKeyIVHABFVJYFXSOR-VHSXEESVSA-N
Species of MetaboliteComponentSourceComments
Fusariumspecies L1 (ncbitaxon:1849704) - PubMed (33180497)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(+/-)-Isoalternatine A (CHEBI:225319) is a indole-3-acetic acids (CHEBI:24803)
IUPAC Name 
[(2R,3S)-3-hydroxybutan-2-yl] 2-(1H-indol-3-yl)acetate
Manual XrefsDatabases
98309164ChemSpider