CHEBI:197806 - Strobilurin I

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Strobilurin I
ChEBI ID CHEBI:197806
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H26O6
Net Charge 0
Average Mass 374.433
Monoisotopic Mass 374.17294
InChI InChI=1S/C21H26O6/c1-14(16(12-24-4)20(23)25-5)7-6-8-15-9-10-17-18(11-15)27-21(2,3)19(22)13-26-17/h6-12,19,22H,13H2,1-5H3/b8-6+,14-7-,16-12+/t19-/m0/s1
InChIKey SMLIFVAKZCGFSF-MJAOIUGUSA-N
SMILES O=C(OC)\C(\C(=C/C=C/C1=CC=2OC([C@@H](O)COC2C=C1)(C)C)\C)=C\OC
Metabolite of Species Details
Agaricusspecies (NCBI:txid1715219) See: DOI
ChEBI Ontology
Outgoing Strobilurin I (CHEBI:197806) is a styrenes (CHEBI:26799)
IUPAC Name
methyl (2E,3Z,5E)-6-[(3S)-3-hydroxy-4,4-dimethyl-2,3-dihydro-1,5-benzodioxepin-7-yl]-2-(methoxymethylidene)-3-methylhexa-3,5-dienoate
Manual Xref Database
8794767 ChemSpider
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