The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

vanillin

Synonyms

Vanillaldehyde

p-hydroxy-m-methoxybenzaldehyde

4-hydroxy-m-anisaldehyde

4-Hydroxy-3-methoxy-benzaldehyde

vanillic aldehyde

methylprotocatechuic aldehyde

vanillaldehyde

4-formyl-2-methoxyphenol

vaniline

4-Hydroxy-3-methoxybenzaldehyde

3-methoxy-4-hydroxybenzaldehyde

C8H8O3

Vanillin

4-hydroxy-3-methoxybenzaldehyde

p-vanillin

ID

http://purl.obolibrary.org/obo/CHEBI_18346

altId

CHEBI:1842

CHEBI:15302

CHEBI:20380

CHEBI:48387

Definition

A benzaldehyde that has formula C8H8O3.

has role

http://purl.obolibrary.org/obo/CHEBI_26619

http://purl.obolibrary.org/obo/CHEBI_22586

http://purl.obolibrary.org/obo/CHEBI_35617

http://purl.obolibrary.org/obo/CHEBI_35623

InChI

InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3

InChIKey

InChIKey=MWOOGOJBHIARFG-UHFFFAOYSA-N

label

vanillin

prefixIRI

obo2:CHEBI_18346

prefLabel

vanillin

SMILES

[H]C(=O)c1ccc(O)c(OC)c1

Synonym

Vanillaldehyde

p-hydroxy-m-methoxybenzaldehyde

4-hydroxy-m-anisaldehyde

4-Hydroxy-3-methoxy-benzaldehyde

vanillic aldehyde

methylprotocatechuic aldehyde

vanillaldehyde

4-formyl-2-methoxyphenol

vaniline

4-Hydroxy-3-methoxybenzaldehyde

3-methoxy-4-hydroxybenzaldehyde

C8H8O3

Vanillin

4-hydroxy-3-methoxybenzaldehyde

p-vanillin

xref

CASRN:121-33-5

KEGG COMPOUND:C00755

ChEMBL:113369

ChEBI:c0193

Beilstein:472792

NIST Chemistry WebBook:121-33-5

Gmelin:3596

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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http://purl.obolibrary.org/obo/CHEBI_18346 CDNO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 FOODON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 GO-PLUS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 OCMR SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 FOBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_18346 FOODON LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 CDNO LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 GO-PLUS LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 CHEBI LOOM
http://purl.bioontology.org/ontology/SNMI/C-31501 SNMI LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C76737 NCIT LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0078032 OCHV LOOM
http://stirdf.jst.go.jp/id/200907027881587853 IOBC LOOM
http://purl.bioontology.org/ontology/NDDF/002588 NDDF LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#15020 OCHV LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000022791 NDFRT LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/11170003 SNOMEDCT LOOM
http://purl.bioontology.org/ontology/RCD/X79Ik RCD LOOM
http://purl.bioontology.org/ontology/VANDF/4020471 VANDF LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C100058 RH-MESH LOOM
http://purl.obolibrary.org/obo/NCIT_C76737 BERO LOOM
http://purl.jp/bio/4/id/200906088881490510 IOBC LOOM
http://purl.bioontology.org/ontology/RXNORM/1368176 RXNORM LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 OCMR LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 FOBI LOOM
http://purl.obolibrary.org/obo/CHEBI_18346 DRON LOOM
http://purl.bioontology.org/ontology/MESH/C100058 MESH LOOM