input word = C00000317

Metabolite InformationStructural formula
Name Gibberellin A99
GA99
Formula C20H26O7
Mw 378.16785319
CAS RN 174693-32-4
C_ID C00000317 ,
InChIKey CUTYINBLQKKDCO-SKKPQTINNA-N
InChICode InChI=1S/C20H26O7/c1-10-5-18-8-20(10,27)4-3-12(18)19(9-21)7-11(22)6-17(2,16(25)26)14(19)13(18)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?/m1/s1
SMILES [C@H]1(C[C@@]([C@@H]2[C@@](C1)([C@H]1[C@]3([C@H]2C(=O)O)C[C@@](CC1)(C(=C)C3)O)C=O)(C)C(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChenopodiaceaeSpinacia oleracea Ref.
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OrganismSpinacia oleracea
ReferenceMander,Phytochem.,43,(1996),23