input word = C00017950

Metabolite InformationStructural formula
Name O-Demethylpaulomycin B
Formula C32H42N2O17S
Mw 758.22041866
CAS RN 113592-08-8
C_ID C00017950 ,
InChIKey VUSAGQZKPBHCGW-FRKPEAEDNA-N
InChICode InChI=1S/C32H42N2O17S/c1-7-16(34-11-52)30(43)51-24-18(10-46-15(6)35)49-27(31(44)9-17(36)22(33)21(26(31)39)28(40)41)23(38)25(24)50-20-8-19(37)32(45,13(4)47-20)14(5)48-29(42)12(2)3/h7,12-14,18-20,23-25,27,37-38,44-45H,8-10,33H2,1-6H3,(H,40,41)/b16-7+/t13-,14-,18-,19+,20+,23-,24-,25-,27+,31-,32-/m0/s1
SMILES C1(=O)[C@](CC(=O)C(=C1C(=O)O)N)(O)[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O[C@@H]1C[C@H]([C@]([C@@H](O1)C)([C@H](C)OC(=O)C(C)C)O)O)OC(=O)/C(=C\C)/N=C=S)COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces paulus strain No.273 Ref.
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OrganismStreptomyces paulus strain No.273
ReferenceArgoudelis,J.Antibiotics,41,(1988),1316