input word = C00016680

Metabolite InformationStructural formula
Name Altromycin G
Formula C45H55NO18
Mw 897.34191396
CAS RN 134887-79-9
C_ID C00016680 ,
InChIKey HUERDIYXSZKKMF-UHFFFAOYNA-N
InChICode InChI=1S/C45H55NO18/c1-16-32(48)25(56-7)14-28(60-16)63-40-18(3)59-26(15-43(40,5)46)20-10-11-21-29(35(20)51)36(52)30-22(34(21)50)12-23(31-24(47)13-27(62-38(30)31)44(6)19(4)64-44)45(55,42(54)58-9)41-37(53)39(57-8)33(49)17(2)61-41/h10-13,16-19,25-26,28,32-33,37,39-41,48-49,51,53,55H,14-15,46H2,1-9H3/t16-,17+,18+,19+,25-,26-,28-,32-,33+,37-,39+,40+,41-,43+,44-,45-/m1/s1
SMILES COC(=O)C(O)(c1cc2c(c3oc(C4(C)OC4C)cc(=O)c13)C(=O)c1c(ccc(C3CC(C)(N)C(OC4CC(OC)C(O)C(C)O4)C(C)O3)c1O)C2=O)C1OC(C)C(O)C(OC)C1O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
--AB 1246E-26 (NRRL 18371) Ref.
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