input word = C00056580

Metabolite InformationStructural formula
Name Diosbulbin I
Formula C29H30O8
Mw 506.19406794
CAS RN 1187951-05-8
C_ID C00056580
InChIKey NFXKFVAWBBOWIJ-WBQZIMCXSA-N
InChICode InChI=1S/C29H30O8/c1-29-14-24(17-9-10-34-15-17)37-28(32)22(29)13-23(26-20-11-19(12-21(26)29)35-27(20)31)36-25(30)8-5-16-3-6-18(33-2)7-4-16/h3-10,15,19-24,26H,11-14H2,1-2H3/b8-5+/t19-,20+,21+,22+,23-,24-,26+,29-/m0/s1
SMILES COc1ccc(/C=C/C(=O)O[C@H]2C[C@@H]3C(=O)O[C@H](c4ccoc4)C[C@@]3(C)[C@@H]3C[C@@H]4C[C@@H](C(=O)O4)[C@@H]23)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDioscoreaceaeDioscorea bulbifera Ref.
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