input word = C00034109

Metabolite InformationStructural formula
Name Periplocin
Formula C36H56O13
Mw 696.37209188
CAS RN 13137-64-9
C_ID C00034109 ,
InChIKey KWBPKUMWVXUSCA-RIEFTLBANA-N
InChICode InChI=1S/C36H56O13/c1-18-31(49-32-30(41)29(40)28(39)25(16-37)48-32)24(44-4)14-27(46-18)47-20-5-9-33(2)22-6-10-34(3)21(19-13-26(38)45-17-19)8-12-36(34,43)23(22)7-11-35(33,42)15-20/h13,18,20-25,27-32,37,39-43H,5-12,14-17H2,1-4H3/t18-,20+,21-,22+,23-,24+,25-,27+,28-,29+,30-,31-,32+,33-,34-,35+,36+/m1/s1
SMILES C1[C@@H](C[C@@]2([C@](C1)([C@@H]1[C@@H](CC2)[C@@]2([C@](CC1)([C@H](CC2)C1=CC(=O)OC1)C)O)C)O)O[C@@H]1O[C@@H]([C@H]([C@H](C1)OC)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePeriploca forrestii Schltr. Ref.
PlantaeApocynaceaePeriploca graeca Ref.
PlantaeApocynaceaePeriploca sepium Bge. Ref.
PlantaeApocynaceaeStrophanthus kombe Ref.
PlantaeApocynaceaeStrophanthus nicholsonii Ref.
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OrganismStrophanthus nicholsonii
ReferenceKatz,Helv.Chim.Acta,28,(1945),478