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CHEBI:234187 - augustate

ChEBI IDCHEBI:234187
ChEBI Nameaugustate
Stars
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H47O4
Net Charge-1
Average Mass471.702
Monoisotopic Mass471.34798
SMILES[H][C@]12CC=C3[C@]4([H])CC(C)(C)CC[C@]4(C(=O)[O-])CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@H](O)[C@@H](O)C[C@]21C
InChIInChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/p-1/t19-,20-,21-,22+,23-,27-,28+,29+,30-/m0/s1
InChIKeyMDZKJHQSJHYOHJ-KRGADYIYSA-M
ChEBI Ontology
Outgoing Relation(s)
augustate (CHEBI:234187) is a monocarboxylic acid anion (CHEBI:35757)
UniProt Name  Source
augustateUniProt
Citations