input word = C00012127

Metabolite InformationStructural formula
Name Hirsutolide
Hirsutolide
Formula C19H24O9
Mw 396.14203237
CAS RN 72712-41-5
C_ID C00012127 ,
InChIKey GSADBENAXUTZTK-DADRBWLHNA-N
InChICode InChI=1S/C19H24O9/c1-10(20)25-9-12-15-13(27-16(12)22)7-17(3)5-6-19(24,28-17)18(4,23)8-14(15)26-11(2)21/h7,14,23-24H,5-6,8-9H2,1-4H3/b13-7+/t14-,17+,18+,19-/m1/s1
SMILES [C@@]1(C[C@H](C2=C(C(=O)O/C/2=C/[C@@]2(CC[C@]1(O2)O)C)COC(=O)C)OC(=O)C)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeVernonia saltensis Ref.
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OrganismVernonia saltensis
ReferenceRustaiyan,Fitoteropia,50,(1979),243