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CHEBI:142466 - 6α,8β-hydroxygermacra-1(10),4,11(13)-trien-12-oate

ChEBI IDCHEBI:142466
ChEBI Name6α,8β-hydroxygermacra-1(10),4,11(13)-trien-12-oate
Stars
ASCII Name6alpha,8beta-hydroxygermacra-1(10),4,11(13)-trien-12-oate
Last Modified3 August 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H21O4
Net Charge-1
Average Mass265.329
Monoisotopic Mass265.14453
SMILESC=C(C(=O)[O-])[C@H]1[C@H](O)/C=C(\C)CC/C=C(\C)C[C@H]1O
InChIInChI=1S/C15H22O4/c1-9-5-4-6-10(2)8-13(17)14(12(16)7-9)11(3)15(18)19/h5,8,12-14,16-17H,3-4,6-7H2,1-2H3,(H,18,19)/p-1/b9-5+,10-8+/t12-,13-,14-/m1/s1
InChIKeyQSQCRXKRLUTFEL-OURLZOILSA-M
ChEBI Ontology
Outgoing Relation(s)
6α,8β-hydroxygermacra-1(10),4,11(13)-trien-12-oate (CHEBI:142466) has functional parent germacra-1(10),4,11(13)-trien-12-oate (CHEBI:61301)
6α,8β-hydroxygermacra-1(10),4,11(13)-trien-12-oate (CHEBI:142466) is a sesquiterpenoid (CHEBI:26658)
UniProt Name  Source
6α,8β-hydroxygermacra-1(10),4,11(13)-trien-12-oateUniProt
Citations