input word = C00027719

Metabolite InformationStructural formula
Name 20-Isoveratramine
Formula C27H39NO2
Mw 409.2980795
CAS RN 212953-94-1
C_ID C00027719 ,
InChIKey MALFODICFSIXPO-VLBDALDZNA-N
InChICode InChI=1S/C27H39NO2/c1-15-11-25(30)26(28-14-15)17(3)20-7-8-21-22-6-5-18-12-19(29)9-10-27(18,4)24(22)13-23(21)16(20)2/h5,7-8,15,17,19,22,24-26,28-30H,6,9-14H2,1-4H3/t15-,17+,19-,22-,24-,25+,26-,27-/m0/s1
SMILES [C@H]1(CC2=CC[C@@H]3[C@@H]([C@]2(CC1)C)Cc1c3ccc(c1C)[C@H]([C@@H]1NC[C@H](C[C@H]1O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum patulum Ref.
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