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CHEBI:142047 - ML-236C carboxylate

ChEBI IDCHEBI:142047
ChEBI NameML-236C carboxylate
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H27O4
Net Charge-1
Average Mass307.410
Monoisotopic Mass307.19148
SMILES[H][C@]12CCCC=C1C=C[C@H](C)[C@@H]2CC[C@@H](O)C[C@@H](O)CC(=O)[O-]
InChIInChI=1S/C18H28O4/c1-12-6-7-13-4-2-3-5-17(13)16(12)9-8-14(19)10-15(20)11-18(21)22/h4,6-7,12,14-17,19-20H,2-3,5,8-11H2,1H3,(H,21,22)/p-1/t12-,14+,15+,16-,17-/m0/s1
InChIKeyAZCVVNXOMBSHNP-WFKFIOEPSA-M
ChEBI Ontology
Outgoing Relation(s)
ML-236C carboxylate (CHEBI:142047) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
UniProt Name  Source
ML-236C carboxylateUniProt
Citations