input word = C00039857

Metabolite InformationStructural formula
Name N-Methyl pachysamine A
N-Methylpachysamine A
Formula C25H46N2
Mw 374.36609948
CAS RN 6584-68-5
C_ID C00039857 ,
InChIKey IHGKQRLXUYWOQB-KDTAWFIYNA-N
InChICode InChI=1S/C25H46N2/c1-17(26(4)5)21-10-11-22-20-9-8-18-16-19(27(6)7)12-14-24(18,2)23(20)13-15-25(21,22)3/h17-23H,8-16H2,1-7H3/t17-,18-,19+,20-,21+,22-,23-,24-,25+/m0/s1
SMILES C1[C@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@H](CC2)[C@H](C)N(C)C)C)C)N(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaePachysandra terminalis Ref.
PlantaeBuxaceaeSarcococca hookeriana Ref.
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