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CHEBI:142120 - 3β-chloro-gibberellin A9

ChEBI IDCHEBI:142120
ChEBI Name3β-chloro-gibberellin A9
Stars
ASCII Name3beta-chloro-gibberellin A9
DefinitionA halo-gibberellin that is gibberellin A9 carrying a chloro substituent at position 3β (2β using gibbane skeletal numbering).
Last Modified6 September 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC19H23ClO4
Net Charge0
Average Mass350.842
Monoisotopic Mass350.12849
SMILES[H][C@]12CC[C@]3([H])[C@](CC1=C)(C2)[C@@H](C(=O)O)[C@@]1([H])[C@@]32CC[C@H](Cl)[C@@]1(C)C(=O)O2
InChIInChI=1S/C19H23ClO4/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,17-,18+,19-/m1/s1
InChIKeyUUUPPKIAWROOSV-NFMPGMCNSA-N
ChEBI Ontology
Outgoing Relation(s)
3β-chloro-gibberellin A9 (CHEBI:142120) has functional parent gibberellin A9 (CHEBI:29605)
3β-chloro-gibberellin A9 (CHEBI:142120) is a halo-gibberellin (CHEBI:142121)
IUPAC Name 
(1R,2S,4aR,4bR,7R,9aR,10S,10aR)-2-chloro-1-methyl-8-methylidene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
Synonyms  Source
(1R,2S,4aR,4bR,7R,9aR,10S,10aR)-2-chloro-1-methyl-8-methylene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acidIUPAC
3β-ClGA9ChEBI
3β-chlorogibberellin A9ChEBI
Citations