input word = C00017049

Metabolite InformationStructural formula
Name Gibberellin A125
GA125
Formula C20H26O7
Mw 378.16785319
CAS RN 328058-47-5
C_ID C00017049 ,
InChIKey RYEQDBJAVSWVOI-TXCZQMRXNA-N
InChICode InChI=1S/C20H26O7/c1-10-7-19-8-20(10,27)12(22)6-11(19)18(9-21)5-3-4-17(2,16(25)26)14(18)13(19)15(23)24/h9,11-14,22,27H,1,3-8H2,2H3,(H,23,24)(H,25,26)/t11-,12-,13+,14+,17+,18+,19?,20-/m0/s1
SMILES C1C[C@@]([C@@H]2[C@@](C1)([C@H]1[C@]3([C@H]2C(=O)O)C[C@@]([C@H](C1)O)(C(=C)C3)O)C=O)(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeFragaria x ananassa Duch. cv. Elsanta Ref.
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OrganismFragaria x ananassa Duch. cv. Elsanta
ReferenceBlake,Phytochem.,55,(2000),887