input word = C00057124

Metabolite InformationStructural formula
Name Physalin Q
Formula C28H30O12
Mw 558.17372642
CAS RN 161407-65-4
C_ID C00057124
InChIKey IRYOOASWRCIZCK-UHFFFAOYSA-N
InChICode InChI=1S/C28H30O12/c1-22-9-16-24(3)28-17(22)19(31)27(39-28,35-10-13(22)20(32)36-16)12-8-15(29)26-7-5-14(38-40-26)18(30)23(26,2)11(12)4-6-25(28,34)21(33)37-24/h5,7,11-17,29,34H,4,6,8-10H2,1-3H3
SMILES O=C(C1CO2)OC3CC1(C)C4C(C2(O5)C6CC(O)C7(C8(C)C6CCC9(O)C45C3(C)OC9=O)OOC(C=C7)C8=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis alkekengi Ref.
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