input word = C00056943

Metabolite InformationStructural formula
Name Physalin O
Formula C28H32O10
Mw 528.19954724
CAS RN 120849-18-5
C_ID C00056943
InChIKey CUSXWWXXAPEFHY-HRLARMCRSA-N
InChICode InChI=1S/C28H32O10/c1-12-21(32)36-17-11-23(12,2)19-20(31)27(35)18-14(24(3)13(10-15(18)29)6-5-7-16(24)30)8-9-26(34)22(33)37-25(17,4)28(19,26)38-27/h5-6,10,12,14-15,17-19,29,34-35H,7-9,11H2,1-4H3/t12-,14+,15-,17-,18+,19+,23-,24+,25+,26+,27-,28+/m1/s1
SMILES O=C1CC=CC([C@]12C)=C[C@@H](O)[C@@]3([C@@]2(CC[C@]4(O)C(O[C@]5([C@H](OC6=O)C[C@](C)([C@@H]6C)[C@@]7([H])[C@@]45O[C@@]3(O)C7=O)C)=O)[H])[H]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis alkekengi Ref.
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