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CHEBI:221151 - (1S)-7-[(2E)-but-2-enoyl]-1,3,3,6-tetramethyl-2,3-dihydro-1H-indene-1-carbaldehyde

Default Structure
ChEBI IDCHEBI:221151
ChEBI Name(1S)-7-[(2E)-but-2-enoyl]-1,3,3,6-tetramethyl-2,3-dihydro-1H-indene-1-carbaldehyde
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O2
Net Charge0
Average Mass270.372
Monoisotopic Mass270.16198
SMILESC/C=C/C(=O)c1c(C)ccc2c1[C@@](C)(C=O)CC2(C)C
InChIInChI=1S/C18H22O2/c1-6-7-14(20)15-12(2)8-9-13-16(15)18(5,11-19)10-17(13,3)4/h6-9,11H,10H2,1-5H3/b7-6+/t18-/m1/s1
InChIKeyYCLWCRCXZPDERE-IPLHWJFFSA-N
Species of MetaboliteComponentSourceComments
Hypoxylon rickii (ncbitaxon:110545) - PubMed (26071840)
ChEBI Ontology
Outgoing Relation(s)
(1S)-7-[(2E)-but-2-enoyl]-1,3,3,6-tetramethyl-2,3-dihydro-1H-indene-1-carbaldehyde (CHEBI:221151) is a indanes (CHEBI:46940)
IUPAC Name 
(1S)-7-[(E)-but-2-enoyl]-1,3,3,6-tetramethyl-2H-indene-1-carbaldehyde
Manual XrefsDatabases
78443420ChemSpider