input word = C00018830

Metabolite InformationStructural formula
Name Validamycin C
Formula C26H45NO18
Mw 659.26366364
CAS RN 12650-70-3
C_ID C00018830 ,
InChIKey IUZLKGXGTJOZDV-SICRFSDNNA-N
InChICode InChI=1S/C26H45NO18/c28-3-7-1-9(15(33)21(39)24(7)45-26-23(41)20(38)17(35)12(5-30)44-26)27-10-2-8(13(31)18(36)14(10)32)6-42-25-22(40)19(37)16(34)11(4-29)43-25/h2,7,9-41H,1,3-6H2/t7-,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19+,20+,21-,22+,23-,24-,25-,26+/m1/s1
SMILES C([C@H]1C[C@H]([C@@H]([C@H]([C@@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)N[C@@H]1C=C([C@@H]([C@H]([C@H]1O)O)O)CO[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Ala
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces hygroscopicus subsp. limoneus Ref.
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