input word = C00013277

Metabolite InformationStructural formula
Name (+)-Geranin A
Geranin A
Formula C30H24O10
Mw 544.13694699
CAS RN 226715-59-9
C_ID C00013277 ,
InChIKey LQRHGTVFFPMWCG-ZLKCPSGNNA-N
InChICode InChI=1S/C30H24O10/c31-15-5-1-13(2-6-15)27-21(36)11-18-19(34)12-23-25(28(18)38-27)26-24-20(35)9-17(33)10-22(24)39-30(40-23,29(26)37)14-3-7-16(32)8-4-14/h1-10,12,21,26-27,29,31-37H,11H2/t21-,26+,27+,29-,30-/m0/s1
SMILES Oc1ccc([C@H]2Oc3c(c(O)cc4c3[C@H]3c5c(O)cc(O)cc5O[C@@](c5ccc(O)cc5)(O4)C3O)C[C@@H]2O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGeraniaceaeGeranium niveum Ref.
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