input word = C00026170

Metabolite InformationStructural formula
Name 7-Angeloylrinderine
7-Angeloylrindrine
O-Demethylheliotrine 7-angelate
Formula C20H31NO6
Mw 381.21513773
CAS RN 116913-25-8
C_ID C00026170 ,
InChIKey MVWPTZQHBOWRTF-BDGMMTDSNA-N
InChICode InChI=1S/C20H31NO6/c1-6-13(4)18(23)27-16-8-10-21-9-7-15(17(16)21)11-26-19(24)20(25,12(2)3)14(5)22/h6-7,12,14,16-17,22,25H,8-11H2,1-5H3/b13-6-/t14-,16+,17-,20+/m1/s1
SMILES C1C[C@@H]([C@@H]2N1CC=C2COC(=O)[C@@]([C@H](O)C)(C(C)C)O)OC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeCynoglossum officinale Ref.
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