input word = C00057540

Metabolite InformationStructural formula
Name Physalin K
Formula C28H30O12
Mw 558.17372642
CAS RN 76045-35-7
C_ID C00057540
InChIKey IRYOOASWRCIZCK-DEZZKOAPSA-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/t11?,12?,13?,14?,15?,16?,17-,22?,23?,24?,25?,26?,27+,28-/m0/s1
SMILES O=C1C2C3(C)[C@H]4[C@]56C(OC(C5(O)CCC(C(C(C(C=C7)OO8)=O)(C)C87C(O)C9)C9[C@@](OC2)(O6)C4=O)=O)(C)C(O1)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis angulata Ref.
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