input word = C00018003

Metabolite InformationStructural formula
Name 18-Dihydrojosamycin
18-Dihydroleucomycin A3
18-Dihydroleukomycin A3
Dihydroleucomycin A3
Formula C42H71NO15
Mw 829.48237061
CAS RN 40361-41-9
C_ID C00018003 ,
InChIKey JUNQZKWSWLJFDU-IRYKFPPONA-N
InChICode InChI=1S/C42H71NO15/c1-23(2)19-32(47)56-40-27(6)53-34(22-42(40,8)50)57-37-26(5)54-41(36(49)35(37)43(9)10)58-38-29(17-18-44)20-24(3)30(46)16-14-12-13-15-25(4)52-33(48)21-31(39(38)51-11)55-28(7)45/h12-14,16,23-27,29-31,34-41,44,46,49-50H,15,17-22H2,1-11H3/b13-12+,16-14+/t24-,25-,26-,27-,29+,30+,31-,34+,35-,36-,37-,38+,39+,40+,41+,42-/m1/s1
SMILES CO[C@@H]1[C@@H](O[C@@H]2OC(C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)CC(C)C)C(C)O3)[C@H](N(C)C)C2O)[C@@H](CCO)C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia mexicana IFO 3927 Ref.
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