input word = C00057543

Metabolite InformationStructural formula
Name Perulactone
Formula C30H46O7
Mw 518.32435382
CAS RN 76994-38-2
C_ID C00057543
InChIKey ODRFODNLKCBNIK-HJGBNWBKSA-N
InChICode InChI=1S/C30H46O7/c1-16-18(15-36-27(16)34)12-25(33)30(5,35)24-9-8-22-21-7-6-19-13-20(32)14-26(37-17(2)31)29(19,4)23(21)10-11-28(22,24)3/h6,16,18,20-26,32-33,35H,7-15H2,1-5H3/t16-,18-,20-,21+,22+,23+,24+,25-,26+,28+,29+,30-/m1/s1
SMILES O=C(C)O[C@@H](C[C@H](O)C1)[C@@]2(C)C1=CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@@]([C@H](O)C[C@H]5[C@@H](C)C(OC5)=O)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis peruviana Ref.
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OrganismPhysalis peruviana
ReferenceGottlieb, H.E. et al., JCS Perkin 1, 1980, 2700-2704 (Perulactone)