input word = C00018458

Metabolite InformationStructural formula
Name Sulfurmycin C
Formula C37H45NO14
Mw 727.28400516
CAS RN 83753-75-7
C_ID C00018458 ,
InChIKey PSUQQLCSYKMETC-AGMYDSMVNA-N
InChICode InChI=1S/C37H45NO14/c1-15(39)13-37(47)14-24(51-25-11-21(38(4)5)35(17(3)50-25)52-26-12-23(41)31(42)16(2)49-26)28-19(30(37)36(46)48-6)10-20-29(34(28)45)33(44)27-18(32(20)43)8-7-9-22(27)40/h7-10,16-17,21,23-26,30-31,35,40-42,45,47H,11-14H2,1-6H3/t16-,17+,21+,23-,24+,25-,26-,30+,31+,35-,37-/m1/s1
SMILES C1[C@@]([C@@H](c2c([C@H]1O[C@H]1O[C@H]([C@@H](O[C@H]3O[C@@H]([C@@H]([C@@H](C3)O)O)C)[C@H](C1)N(C)C)C)c(c1c(c2)C(=O)c2c(C1=O)c(ccc2)O)O)C(=O)OC)(CC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces galilaeus OBB-111-610 Ref.
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OrganismStreptomyces galilaeus OBB-111-610
ReferenceHoshino,J. Antibiotics,35,(1982),1271