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CHEBI:234085 - 3-hydroxyurs-12-ene-23,28-dicarboxylate

ChEBI IDCHEBI:234085
ChEBI Name3-hydroxyurs-12-ene-23,28-dicarboxylate
Stars
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC30H44O5
Net Charge-2
Average Mass484.677
Monoisotopic Mass484.31997
SMILES[H][C@]12CC=C3[C@@](C)(CC[C@@]4(C(=O)[O-])CC[C@@H](C)[C@H](C)[C@@]34[H])[C@]1(C)CC[C@]1([H])[C@]2(C)CC[C@H](O)[C@@]1(C)C(=O)[O-]
InChIInChI=1S/C30H46O5/c1-17-9-14-30(25(34)35)16-15-27(4)19(23(30)18(17)2)7-8-20-26(3)12-11-22(31)29(6,24(32)33)21(26)10-13-28(20,27)5/h7,17-18,20-23,31H,8-16H2,1-6H3,(H,32,33)(H,34,35)/p-2/t17-,18+,20-,21-,22+,23+,26-,27-,28-,29+,30+/m1/s1
InChIKeyOVHNDEYISNIAOA-AYBYFDMCSA-L
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyurs-12-ene-23,28-dicarboxylate (CHEBI:234085) is a dicarboxylic acid dianion (CHEBI:28965)
UniProt Name  Source
3-hydroxyurs-12-ene-23,28-dicarboxylateUniProt