input word = C00056923

Metabolite InformationStructural formula
Name Polypodoside B
Formula C39H62O13
Mw 738.41904207
CAS RN 120015-16-9
C_ID C00056923
InChIKey DMRIOWKDQLGGAP-UHFFFAOYSA-N
InChICode InChI=1S/C39H62O13/c1-17-6-9-27(50-35(17)52-36-33(46)31(44)29(42)19(3)48-36)18(2)22-7-8-23-21-15-26(41)25-14-20(10-12-39(25,5)24(21)11-13-38(22,23)4)49-37-34(47)32(45)30(43)28(16-40)51-37/h15,17-20,22-25,27-37,40,42-47H,6-14,16H2,1-5H3
SMILES OC(C(O)C(O)C(CO)O1)C1OC2CCC(C3C2)(C)C4CCC5(C)C(CCC5C(C)C6CCC(C)C(OC7OC(C)C(O)C(O)C7O)O6)C4=CC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolypodiaceaePolypodium glycyrrhiza Ref.
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