input word = C00047200

Metabolite InformationStructural formula
Name Buxmicrophylline G
(+)-Buxmicrophylline G
Formula C36H54N2O5
Mw 594.40327285
CAS RN 1101859-19-1
C_ID C00047200 ,
InChIKey PGSGUFFVLOKDAE-BOFSIJDYNA-N
InChICode InChI=1S/C36H54N2O5/c1-22(38(5)6)31-25(41)19-34(4)28-12-11-27-32(2,21-39)29(14-15-35(27)20-36(28,35)17-16-33(31,34)3)37-30(42)13-9-23-8-10-26(43-7)24(40)18-23/h8-10,13,18,22,25,27-29,31,39-41H,11-12,14-17,19-21H2,1-7H3,(H,37,42)/b13-9+/t22-,25+,27-,28-,29-,31-,32-,33+,34-,35+,36-/m0/s1
SMILES C1[C@]23[C@H]([C@]4([C@](C1)([C@H]([C@@H](C4)O)[C@@H](N(C)C)C)C)C)CC[C@@H]1[C@@]2(CC[C@@H]([C@]1(CO)C)NC(=O)/C=C/c1ccc(c(c1)O)OC)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeBuxus nicrophylla Ref.
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