input word = C00016678

Metabolite InformationStructural formula
Name Altromycin E
Formula C46H57NO17
Mw 895.3626494
CAS RN 134887-77-7
C_ID C00016678 ,
InChIKey IISVQPDVYGFQCS-UHFFFAOYNA-N
InChICode InChI=1S/C46H57NO17/c1-17-35(50)27(56-8)15-30(60-17)63-43-19(3)59-28(16-45(43,5)47-7)21-11-23-31(25(48)12-21)38(53)33-24(37(23)52)13-22(32-26(49)14-29(62-40(32)33)46(6)20(4)64-46)34(44(55)58-10)41-39(54)42(57-9)36(51)18(2)61-41/h11-14,17-20,27-28,30,34-36,39,41-43,47-48,50-51,54H,15-16H2,1-10H3/t17-,18-,19+,20-,27-,28-,30+,34+,35+,36-,39+,41+,42?,43+,45-,46+/m0/s1
SMILES [C@@H]1([C@H](C[C@H](O[C@H]1C)O[C@H]1[C@](C)(C[C@H](O[C@@H]1C)c1cc(c2c(c1)C(=O)c1c(C2=O)c2c(c(c1)[C@H]([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)OC)O)C(=O)OC)c(=O)cc(o2)[C@@]1(O[C@H]1C)C)O)NC)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
--AB 1246E-26 (NRRL 18371) Ref.
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