input word = C00016798

Metabolite InformationStructural formula
Name Pradimicin FB
Formula C35H36N2O15
Mw 724.2115685
CAS RN 131426-61-4
C_ID C00016798 ,
InChIKey YLKHGLQUCDIHFA-ZKWHONDBNA-N
InChICode InChI=1S/C35H36N2O15/c1-10-5-16-22(28(43)19(10)33(47)37-17(9-38)34(48)49)21-14(27(42)32(16)52-35-31(46)30(45)24(36-3)11(2)51-35)8-15-23(29(21)44)26(41)13-6-12(50-4)7-18(39)20(13)25(15)40/h5-8,11,17,24,27,30-32,35-36,38-39,42-46H,9H2,1-4H3,(H,37,47)(H,48,49)/t11-,17+,24+,27+,30+,31-,32+,35+/m1/s1
SMILES CN[C@H]1C(C)O[C@@H](O[C@H]2c3cc(C)c(C(=O)NC(CO)C(=O)O)c(O)c3-c3c(cc4c(c3O)C(=O)c3cc(OC)cc(O)c3C4=O)C2O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
BacteriaThermomonosporaceaeActinomadura spinosa AA0851 Ref.
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OrganismActinomadura spinosa AA0851
ReferenceSaitoh,J.Antibiotics 46,(1993),398