input word = C00060425

Metabolite InformationStructural formula
Name Gibberellin A95 isolactone
Formula C19H22O5
Mw 330.14672381
CAS RN 178959-61-0
C_ID C00060425
InChIKey VLTQADXREMVNJX-OWJXUOKSSA-N
InChICode InChI=1S/C19H22O5/c1-9-6-18-8-19(9,23)4-3-12(18)11-5-10-7-17(2,16(22)24-10)13(11)14(18)15(20)21/h5,10,12-14,23H,1,3-4,6-8H2,2H3,(H,20,21)/t10-,12+,13-,14-,17-,18+,19+/m1/s1
SMILES C=C1CC23CC1(O)CCC2C1=CC2CC(C)(C(=O)O2)C1C3C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeRaphanus sativus Ref.
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