input word = C00017753

Metabolite InformationStructural formula
Name FR 900452
Formula C22H25N3O3S
Mw 411.16166242
CAS RN 101706-33-6
C_ID C00017753 ,
InChIKey UAPDNDKYPBHNQT-SMKOHTRFNA-N
InChICode InChI=1S/C22H25N3O3S/c1-12(18-13-7-4-5-9-16(13)25(2)22(18)28)19-20(14-8-6-10-17(14)26)23-15(11-29-3)21(27)24-19/h4-7,9-10,12,15,18-19,23H,8,11H2,1-3H3,(H,24,27)/b20-14-/t12-,15-,18-,19-/m0/s1
SMILES c1ccc2c(c1)N(C(=O)[C@H]2[C@@H]([C@H]1/C(=C/2\CC=CC2=O)/N[C@H](C(=O)N1)CSC)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces phaeofaciens No.7739 Ref.
zoom in