input word = C00016280

Metabolite InformationStructural formula
Name (+)-Madindoline B
Madindoline B
Formula C22H27NO4
Mw 369.19400836
CAS RN 184877-65-4
C_ID C00016280 ,
InChIKey XPVQXXLKOCZMGG-XWIYYFDGNA-N
InChICode InChI=1S/C22H27NO4/c1-4-5-8-15-14(2)18(24)21(3,19(15)25)13-23-17-10-7-6-9-16(17)22(26)11-12-27-20(22)23/h6-7,9-10,20,26H,4-5,8,11-13H2,1-3H3/t20-,21-,22+/m0/s1
SMILES CCCCC1=C(C)C(=O)[C@](C)(CN2c3ccccc3[C@]3(O)CCO[C@H]23)C1=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces nitrosporeus K93-0711 Ref.
BacteriaStreptomycetaceaeStreptomyces sp. K93-0711 Ref.
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