CHEBI:207478 - Graphostromol B

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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 Graphostromol B
ChEBI ID CHEBI:207478
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H30O5
Net Charge 0
Average Mass 326.433
Monoisotopic Mass 326.20932
InChI InChI=1S/C18H30O5/c1-13(19)17(3,4)10-8-7-9-15(21)11-16(22)18(5,6)12-23-14(2)20/h7-10,13,15,19,21H,11-12H2,1-6H3/b9-7+,10-8+/t13-,15?/m0/s1
InChIKey AXDICNFRLXYFCS-QLHWVNKCSA-N
SMILES O=C(C(COC(=O)C)(C)C)CC(O)/C=C/C=C/C([C@@H](O)C)(C)C
Metabolite of Species Details
Graphostromaspecies (NCBI:txid1933438) See: PubMed
ChEBI Ontology
Outgoing Graphostromol B (CHEBI:207478) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(6E,8E,11S)-5,11-dihydroxy-2,2,10,10-tetramethyl-3-oxododeca-6,8-dienyl] acetate
Manual Xref Database
81360840 ChemSpider
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