input word = C00054468

Metabolite InformationStructural formula
Name 4-Deoxyphysalolactone
Formula C28H39ClO7
Mw 522.23843131
CAS RN 78286-00-7
C_ID C00054468
InChIKey DSFWZSDSZFDOMA-KMMUWFSYSA-N
InChICode InChI=1S/C28H39ClO7/c1-15-13-21(36-22(31)16(15)2)25(5,32)28(35)12-11-26(33)18-14-19(29)27(34)9-6-7-20(30)24(27,4)17(18)8-10-23(26,28)3/h6-7,17-19,21,32-35H,8-14H2,1-5H3/t17-,18+,19-,21+,23-,24-,25-,26+,27+,28-/m0/s1
SMILES CC1=C(C)C(=O)O[C@@H]([C@](C)(O)[C@]2(O)CC[C@@]3(O)[C@@H]4C[C@H](Cl)[C@]5(O)CC=CC(=O)[C@]5(C)[C@H]4CC[C@]23C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis peruviana Ref.
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OrganismPhysalis peruviana
ReferenceFrolow, F. et al., JCS Perkin 1, 1981, 1029-1032 (isol, struct)