input word = C00018380

Metabolite InformationStructural formula
Name Fredericamycin A
NSC 305263
Formula C30H21NO9
Mw 539.12163128
CAS RN 80455-68-1
C_ID C00018380 ,
InChIKey BZONSJUONOFNNP-OGPVPJFMNA-N
InChICode InChI=1S/C30H21NO9/c1-3-4-5-6-14-10-13-9-12-7-8-30(22(12)26(36)17(13)29(39)31-14)27(37)20-21(28(30)38)25(35)19-18(24(20)34)15(32)11-16(40-2)23(19)33/h3-6,9-11,34-36H,7-8H2,1-2H3,(H,31,39)/b4-3+,6-5+/t30-/m0/s1
SMILES [nH]1c(cc2c(c1=O)c(c1c(c2)CC[C@@]21C(=O)c1c(C2=O)c(c2c(c1O)C(=O)C(=CC2=O)OC)O)O)/C=C/C=C/C
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Phe
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces griseus FCRC-48 Ref.
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