input word = C00025482

Metabolite InformationStructural formula
Name Buxaquamarine
(+)-Buxaquamarine
Formula C26H39NO2
Mw 397.2980795
CAS RN 98776-20-6
C_ID C00025482 ,
InChIKey DCONXLQPDFRUCW-OXCRSNKGNA-N
InChICode InChI=1S/C26H39NO2/c1-17(28)20-11-13-26(4)22-8-7-21-18(14-19(22)10-12-25(20,26)3)6-9-23-24(21,2)15-29-16-27(23)5/h10,14,20-23H,6-9,11-13,15-16H2,1-5H3/t20-,21-,22-,23-,24-,25-,26+/m1/s1
SMILES [C@@H]12CCC3=CC4=CC[C@]5([C@]([C@@H]4CC[C@H]3[C@]1(COCN2C)C)(CC[C@@H]5C(=O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeBuxus papilosa Ref.
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