input word = C00028349

Metabolite InformationStructural formula
Name Holyrine A
Formula C26H24N4O3
Mw 440.18484066
CAS RN 249512-77-4
C_ID C00028349 ,
InChIKey QNQXRLNOOGRQEB-ATMOASJENA-N
InChICode InChI=1S/C26H24N4O3/c1-12-25(31)16(27)10-19(33-12)30-18-9-5-3-7-14(18)21-22-15(11-28-26(22)32)20-13-6-2-4-8-17(13)29-23(20)24(21)30/h2-9,12,16,19,25,29,31H,10-11,27H2,1H3,(H,28,32)/t12-,16-,19-,25-/m1/s1
SMILES c1ccc2c(c1)n(c1c2c2c(c3c1[nH]c1c3cccc1)CNC2=O)[C@H]1C[C@H]([C@@H]([C@H](O1)C)O)N
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate IPP
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. N96C-47 Ref.
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OrganismStreptomyces sp. N96C-47
ReferenceWilliams,Tetrahedron Lett.,40,(1999),7171