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CHEBI:143370 - [1-ethyl-8-(hydroxymethyl)-3H,4H,9H-pyrano[3,4-b]indol-1-yl]acetic acid

ChEBI IDCHEBI:143370
ChEBI Name[1-ethyl-8-(hydroxymethyl)-3H,4H,9H-pyrano[3,4-b]indol-1-yl]acetic acid
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FormulaC16H19NO4
Net Charge0
Average Mass289.331
Monoisotopic Mass289.13141
SMILESCC[C@@]1(CC(=O)O)OCCc2c1nc1c(CO)cccc21
InChIInChI=1S/C16H19NO4/c1-2-16(8-13(19)20)15-12(6-7-21-16)11-5-3-4-10(9-18)14(11)17-15/h3-5,17-18H,2,6-9H2,1H3,(H,19,20)/t16-/m0/s1
InChIKeyHIEGNHLFLGNPQE-INIZCTEOSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
[1-ethyl-8-(hydroxymethyl)-3H,4H,9H-pyrano[3,4-b]indol-1-yl]acetic acid (CHEBI:143370) is a monocarboxylic acid (CHEBI:25384)
[1-ethyl-8-(hydroxymethyl)-3H,4H,9H-pyrano[3,4-b]indol-1-yl]acetic acid (CHEBI:143370) is a organic heterotricyclic compound (CHEBI:26979)