input word = C00018490

Metabolite InformationStructural formula
Name Ansatrienin A3
Formula C34H46N2O8
Mw 610.32541646
CAS RN 85819-31-4
C_ID C00018490 ,
InChIKey JBNJKAJZJDHYFN-YIHNICRPNA-N
InChICode InChI=1S/C34H46N2O8/c1-21(2)17-30(38)35-24(5)34(42)44-29-16-11-9-7-8-10-15-27(43-6)20-31(39)36-28-19-26(37)18-25(33(28)41)14-12-13-22(3)32(40)23(29)4/h7-11,13,15,18-19,21,23-24,27,29,32,40H,12,14,16-17,20H2,1-6H3,(H,35,38)(H,36,39)/b8-7+,11-9-,15-10+,22-13+/t23-,24-,27-,29+,32-/m1/s1
SMILES N1C2=CC(=O)C=C(CC/C=C(/[C@H]([C@@H]([C@H](C/C=C\C=C\C=C\[C@H](CC1=O)OC)OC(=O)[C@@H](C)NC(=O)CC(C)C)C)O)\C)C2=O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces collinus Ref.
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