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CHEBI:142124 - 3-epi-gibberellin A1

ChEBI IDCHEBI:142124
ChEBI Name3-epi-gibberellin A1
Stars
ASCII Name3-epi-gibberellin A1
DefinitionAn epi-gibberellin that is gibberellin A1 differing in configuration at C-3 (C-2 using gibbane skeletal numbering).
Last Modified6 September 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC19H24O6
Net Charge0
Average Mass348.395
Monoisotopic Mass348.15729
SMILES[H][C@@]12CC[C@]3(O)C[C@]1(CC3=C)[C@@H](C(=O)O)[C@@]1([H])[C@@]23CC[C@@H](O)[C@@]1(C)C(=O)O3
InChIInChI=1S/C19H24O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h10-13,20,24H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12-,13-,16-,17+,18+,19-/m1/s1
InChIKeyJLJLRLWOEMWYQK-WWSAFQOPSA-N
ChEBI Ontology
Outgoing Relation(s)
3-epi-gibberellin A1 (CHEBI:142124) is a epi-gibberellin (CHEBI:142123)
IUPAC Name 
(1S,2R,4aR,4bR,7S,9aS,10S,10aR)-2,7-dihydroxy-1-methyl-8-methylidene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
Synonyms  Source
3-epiGA1ChEBI
3-epigibberellin A1ChEBI
(1S,2R,4aR,4bR,7S,9aS,10S,10aR)-2,7-dihydroxy-1-methyl-8-methylene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acidIUPAC
Manual XrefsDatabases
HMDB0040944HMDB
Citations