1D-1-O-(indol-3-yl)acetyl-myo-inositol (CHEBI:15711)

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ChEBI Name	*1D-1-O-(indol-3-yl)acetyl-myo-inositol*

ChEBI ID	CHEBI:15711

ChEBI ASCII Name	1D-1-O-(indol-3-yl)acetyl-myo-inositol

Definition	A cyclitol ester that is 1D-myo-inositol bearing a indol-3-acetyl substituent at position 1.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:5908, CHEBI:14450, CHEBI:19425

Supplier Information

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Formula

C16H19NO7

Net Charge

Average Mass

337.32460

Monoisotopic Mass

337.11615

InChI

InChI=1S/C16H19NO7/c18-10(5-7-6-17-9-4-2-1-3-8(7)9)24-16-14(22)12(20)11(19)13(21)15(16)23/h1-4,6,11-17,19-23H,5H2/t11-,12-,13+,14-,15-,16-/m1/s1

InChIKey

XUACNUJFOIKYPQ-BKQXGZDCSA-N

SMILES

O[C@H]1[C@H](O)[C@@H](O)[C@H](OC(=O)Cc2c[nH]c3ccccc23)[C@H](O)[C@@H]1O

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via indoleacetic acid conjugate )

ChEBI Ontology
Outgoing	1D-1-O-(indol-3-yl)acetyl-myo-inositol (CHEBI:15711) has functional parent myo-inositol (CHEBI:17268) 1D-1-O-(indol-3-yl)acetyl-myo-inositol (CHEBI:15711) is a cyclitol ester (CHEBI:64426) 1D-1-O-(indol-3-yl)acetyl-myo-inositol (CHEBI:15711) is a indoleacetic acid ester conjugate (CHEBI:64633) 1D-1-O-(indol-3-yl)acetyl-myo-inositol (CHEBI:15711) is a indoles (CHEBI:24828)

IUPAC Name

1D-1-O-(indol-3-yl)acetyl-myo-inositol

Synonyms	Sources
Indol-3-ylacetyl-1D-myo-inositol	KEGG COMPOUND
Indol-3-ylacetyl-myo-inositol	KEGG COMPOUND
indole-3-acetyl-1D-myo-inositol	UniProt
Indole-3-acetyl-myo-inositol	KEGG COMPOUND
Indole-3-ylacetyl-myo-inositol	KEGG COMPOUND

Last Modified

04 August 2014