input word = C00018335

Metabolite InformationStructural formula
Name Sulfurmycin B
Formula C43H51NO16
Mw 837.32078459
CAS RN 78193-30-3
C_ID C00018335 ,
InChIKey DONDQYGRHMLYMF-RCABVKEXNA-N
InChICode InChI=1S/C43H51NO16/c1-17(45)15-43(52)16-29(33-22(35(43)41(51)53-7)11-23-34(38(33)50)37(49)32-21(36(23)48)9-8-10-25(32)46)58-30-12-24(44(5)6)39(19(3)54-30)59-31-14-27-40(20(4)55-31)60-42-28(57-27)13-26(47)18(2)56-42/h8-11,18-20,24,27-31,35,39-40,42,46,50,52H,12-16H2,1-7H3/t18-,19+,20-,24+,27-,28+,29+,30-,31-,35+,39-,40-,42-,43+/m0/s1
SMILES COC(=O)C1c2cc3c(c(O)c2C(OC2CC(N(C)C)C(O[C@@H]4CC5OC6CC(=O)C(C)OC6OC5C(C)O4)C(C)O2)C[C@]1(O)CC(C)=O)C(=O)c1c(O)cccc1C3=O
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces galilaeus OBB-111 Ref.
zoom in