input word = C00025513

Metabolite InformationStructural formula
Name Holarricine
Formula C21H32N2O3
Mw 360.2412929
CAS RN 84294-76-8
C_ID C00025513 ,
InChIKey QHVKOPHHINRKTD-CATPSLORNA-N
InChICode InChI=1S/C21H32N2O3/c1-10(22)17-16(25)8-14-13-4-3-11-7-12(23)5-6-21(11,2)19(13)20(26)15(9-24)18(14)17/h3,10,12-15,17-19,24H,4-9,22-23H2,1-2H3/t10-,12-,13-,14+,15-,17-,18-,19+,21-/m0/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)C(=O)[C@H]([C@@H]1[C@@H]3CC(=O)[C@@H]1[C@H](C)N)CO)N
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeHolarrhena antidysenterica Ref.
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