input word = C00037274

Metabolite InformationStructural formula
Name Homodestruxin B
Formula C31H53N5O7
Mw 607.39449908
CAS RN 110538-19-7
C_ID C00037274 ,
InChIKey RUIUEVIQLGHWTC-JFDFQRIZNA-N
InChICode InChI=1S/C31H53N5O7/c1-10-18(4)24-29(40)35(9)25(19(5)11-2)30(41)34(8)21(7)27(38)32-16-15-23(37)43-26(20(6)12-3)31(42)36-17-13-14-22(36)28(39)33-24/h18-22,24-26H,10-17H2,1-9H3,(H,32,38)(H,33,39)/t18-,19+,20-,21-,22-,24-,25+,26?/m0/s1
SMILES [C@@H]1(N(C(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@H](OC(=O)CCNC(=O)[C@@H](N(C1=O)C)C)[C@H](CC)C)CCC2)[C@@H](C)CC)C)[C@H](C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
FungiDothideomycetesAlternaria brassicae Ref.
FungiIncertae sedisTrichothecium roseum TT103 Ref.
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OrganismTrichothecium roseum TT103
ReferencePedras,Phytochem.,59,(2002),579