input word = C00045582

Metabolite InformationStructural formula
Name 6'-O-E-p-Methoxycinnamoylharpagide
(-)-6'-O-E-p-Methoxycinnamoylharpagide
Formula C25H32O12
Mw 524.18937649
CAS RN 474411-44-4
C_ID C00045582 ,
InChIKey FLGNDYLGJFFGQZ-KKMVOPDJNA-N
InChICode InChI=1S/C25H32O12/c1-24(31)11-16(26)25(32)9-10-34-23(21(24)25)37-22-20(30)19(29)18(28)15(36-22)12-35-17(27)8-5-13-3-6-14(33-2)7-4-13/h3-10,15-16,18-23,26,28-32H,11-12H2,1-2H3/b8-5+/t15-,16-,18-,19+,20-,21-,22+,23+,24+,25+/m1/s1
SMILES O1C=C[C@]2([C@H]([C@@H]1O[C@H]1[C@H](O)[C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1ccc(cc1)OC)O)O)[C@](C[C@H]2O)(O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeScrophulariaceaeScrophularia buergeriana Ref.
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