input word = C00016009

Metabolite InformationStructural formula
Name Nothramicin
Formula C30H37NO11
Mw 587.23666103
CAS RN 205752-47-2
C_ID C00016009 ,
InChIKey XXHMZNPASHQZPM-UHFFFAOYNA-N
InChICode InChI=1S/C30H37NO11/c1-12-26(36)29(2,31(4)5)11-17(41-12)42-25-19-14(27(37)30(3,38)28(25)40-7)10-13-18(23(19)34)24(35)20-15(32)8-9-16(39-6)21(20)22(13)33/h8-10,12,17,25-28,32,34,36-38H,11H2,1-7H3/t12-,17+,25+,26+,27-,28-,29+,30-/m1/s1
SMILES [C@@H]1([C@]([C@@H](c2c([C@@H]1O[C@@H]1O[C@@H]([C@@H]([C@@](C1)(C)N(C)C)O)C)c(c1c(c2)C(=O)c2c(C1=O)c(ccc2OC)O)O)O)(C)O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
BacteriaNocardiaceaeNocardia sp. MJ896-43F17 Ref.
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