input word = C00040004

Metabolite InformationStructural formula
Name Physalin II
Formula C29H34O10
Mw 542.21519731
CAS RN 1012064-98-0
C_ID C00040004 ,
InChIKey NNFMRPSQYZBXBB-LYBAPFIANA-N
InChICode InChI=1S/C29H34O10/c1-13-20(31)37-19-12-24(13,2)21-28(35)17-7-6-14-10-15(36-5)11-18(30)25(14,3)16(17)8-9-27(34)22(32)38-26(19,4)29(21,27)39-23(28)33/h6-7,10,13,15-17,19,21,34-35H,8-9,11-12H2,1-5H3/t13-,15-,16+,17+,19-,21-,24-,25+,26+,27+,28+,29+/m1/s1
SMILES [C@]12([C@]34[C@@H]([C@@]([C@@H]5[C@H](CC1)[C@@]1(C(=C[C@H](CC1=O)OC)C=C5)C)(C(=O)O4)O)[C@@]1(C[C@H]([C@@]3(OC2=O)C)OC(=O)[C@H]1C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis alkekengi var.franchetii Ref.
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