input word = C00016430

Metabolite InformationStructural formula
Name LL-D 37187alpha
Martinomycin
Formula C49H84O17
Mw 944.57085126
CAS RN 160791-16-2
C_ID C00016430 ,
InChIKey VIAPPZHHJMCDEJ-XDUWHTPSNA-N
InChICode InChI=1S/C49H84O17/c1-24-40(62-39-21-19-32(54-11)30(7)59-39)26(3)47(10,52)65-41(24)35-17-16-33(60-35)34-18-20-37(61-34)46(9)43(57-14)28(5)49(66-46)25(2)36(55-12)22-31(63-49)23-38-45(8,58-15)42(56-13)27(4)48(53,64-38)29(6)44(50)51/h24-43,52-53H,16-23H2,1-15H3,(H,50,51)/t24-,25+,26+,27-,28+,29-,30+,31-,32-,33+,34-,35+,36+,37+,38-,39-,40-,41-,42-,43+,45+,46-,47-,48-,49-/m0/s1
SMILES [C@@H]1([C@@H]([C@@]([C@@H](O[C@@]1([C@H](C(=O)O)C)O)C[C@H]1O[C@]2([C@@H]([C@@H](C1)OC)C)[C@@H]([C@H]([C@@](O2)([C@@H]1O[C@@H](CC1)[C@H]1CC[C@@H](O1)[C@@H]1[C@H]([C@@H]([C@H]([C@](O1)(O)C)C)O[C@H]1CC[C@@H]([C@H](O1)C)OC)C)C)OC)C)(OC)C)OC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces salvialis LL-D37187 Ref.
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