input word = C00016303

Metabolite InformationStructural formula
Name Saccharocarcin C
Formula C61H91NO17
Mw 1109.62870049
CAS RN 158475-34-4
C_ID C00016303 ,
InChIKey DSNXNYCRIPJOLF-VVKNKFQJNA-N
InChICode InChI=1S/C61H91NO17/c1-14-38-15-16-39-23-32(6)52(78-48-27-59(12,70)55(36(10)74-48)62-37(11)63)30(4)21-28(2)41-18-17-40-50(60(41,13)56(67)49-57(68)61(39,26-38)79-58(49)69)29(3)22-31(5)53(40)76-45-20-19-44(33(7)71-45)75-46-25-43(65)54(35(9)73-46)77-47-24-42(64)51(66)34(8)72-47/h15-18,21,23,29-31,33-36,38-48,50-55,64-66,68,70H,14,19-20,22,24-27H2,1-13H3,(H,62,63)/b28-21-,32-23+/t29-,30+,31-,33-,34+,35+,36-,38+,39-,40+,41-,42+,43+,44+,45+,46-,47-,48+,50+,51-,52-,53-,54+,55-,59+,60-,61+/m0/s1
SMILES [C@H]1(C=C[C@@H]2[C@@]3(C1)OC(=O)C(=C3O)C(=O)[C@]1([C@H](/C(=C\[C@H]([C@@H](/C(=C/2)/C)O[C@@H]2C[C@@]([C@H]([C@@H](O2)C)NC(=O)C)(C)O)C)/C)C=C[C@@H]2[C@H]1[C@H](C[C@@H]([C@@H]2O[C@H]1O[C@H]([C@@H](CC1)O[C@@H]1O[C@@H]([C@H]([C@@H](C1)O)O[C@@H]1O[C@@H]([C@@H]([C@@H](C1)O)O)C)C)C)C)C)C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
--Lechevalieria aerocolonigenes subsp. antibiotica Ref.
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OrganismLechevalieria aerocolonigenes subsp. antibiotica
ReferenceHoran,J.Antibiotics 50,(1997),119