input word = C00015659

Metabolite InformationStructural formula
Name Benzoxazomycin
Formula C36H48N2O8
Mw 636.34106652
CAS RN 309929-01-9
C_ID C00015659 ,
InChIKey QOCVCLXEQORBEY-NKLQVEGRNA-N
InChICode InChI=1S/C36H48N2O8/c1-21-12-11-15-25-18-26(39)19-27-34(25)45-29(32-30(44-4)20-31(40)38(27)32)17-10-6-9-16-28(22(2)33(21)41)46-36(43)23(3)37-35(42)24-13-7-5-8-14-24/h6,9-10,12,17-19,22-24,28-30,32-33,39,41H,5,7-8,11,13-16,20H2,1-4H3,(H,37,42)/b9-6+,17-10+,21-12-/t22-,23+,28-,29-,30-,32-,33-/m0/s1
SMILES C1CCC(CC1)C(=O)N[C@H](C)C(=O)O[C@H]1C/C=C/C=C/[C@@H]2Oc3c(CC/C=C(\[C@@H]([C@H]1C)O)/C)cc(cc3N1[C@@H]2[C@H](CC1=O)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. MJ672-m3 Ref.
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