input word = C00057657

Metabolite InformationStructural formula
Name Physalolactone C
Formula C28H37ClO7
Mw 520.22278125
CAS RN 92594-02-0
C_ID C00057657
InChIKey BSLUVQZIEQFEOT-DWHGKTCXSA-N
InChICode InChI=1S/C28H37ClO7/c1-14-12-22(36-23(32)15(14)2)26(5,33)27(34)11-9-17-16-13-19(29)28(35)21(31)7-6-20(30)25(28,4)18(16)8-10-24(17,27)3/h6-7,9,16,18-19,21-22,31,33-35H,8,10-13H2,1-5H3/t16-,18-,19-,21-,22+,24-,25-,26-,27-,28-/m0/s1
SMILES CC(C[C@](O1)([H])[C@@]([C@]2(O)CC=C3[C@]([C@]([C@@]45C)([H])CC[C@@]32C)([H])C[C@H](Cl)[C@]5(O)[C@@H](O)C=CC4=O)(O)C)=C(C1=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis peruviana Ref.
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