input word = C00034104

Metabolite InformationStructural formula
Name Periforoside I
(+)-Periforoside I
Formula C36H54O13
Mw 694.35644181
CAS RN 130812-53-2
C_ID C00034104 ,
InChIKey RUFXSPCZRXDLNJ-QWEJETFKNA-N
InChICode InChI=1S/C36H54O13/c1-18-30(49-31-29(42)28(41)27(40)23(16-38)48-31)19(15-37)13-26(46-18)47-21-4-8-34(3)24-6-7-33(2)22(20-12-25(39)45-17-20)5-9-35(24,32(33)43)10-11-36(34,44)14-21/h12,18-19,21-24,26-31,37-38,40-42,44H,4-11,13-17H2,1-3H3/t18-,19+,21+,22-,23-,24?,26+,27-,28+,29-,30-,31+,33-,34-,35-,36+/m1/s1
SMILES C[C@H]1O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC[C@@]5(C)C(=O)C4(CC[C@@H]5C4=CC(=O)OC4)CC[C@]3(O)C2)C[C@@H](CO)C1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePeriploca forrestii Schltr. Ref.
PlantaeApocynaceaePeriploca sepium Bge. Ref.
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