input word = C00018101

Metabolite InformationStructural formula
Name Deisovalerylblastmycin
Formula C21H28N2O8
Mw 436.18456589
CAS RN 60504-95-2
C_ID C00018101 ,
InChIKey RQVHZRRXZBBXMY-BEIRAIQONA-N
InChICode InChI=1S/C21H28N2O8/c1-4-5-7-14-17(25)12(3)31-21(29)16(11(2)30-20(14)28)23-19(27)13-8-6-9-15(18(13)26)22-10-24/h6,8-12,14,16-17,25-26H,4-5,7H2,1-3H3,(H,22,24)(H,23,27)/t11-,12+,14-,16+,17+/m1/s1
SMILES CCCC[C@H]1C(=O)O[C@H](C)[C@H](NC(=O)c2cccc(NC=O)c2O)C(=O)O[C@@H](C)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. 5140-A1 Ref.
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