input word = C00034540

Metabolite InformationStructural formula
Name Homodolastatin 16
Formula C48H72N6O10
Mw 892.53099256
CAS RN 544417-31-4
C_ID C00034540 ,
InChIKey FHDYETHRKSGXJQ-UEJFLCDJNA-N
InChICode InChI=1S/C48H72N6O10/c1-11-29(6)39-45(59)53-24-16-21-35(53)42(56)50-38(30(7)26-33-18-13-12-14-19-33)44(58)52-23-15-20-34(52)41(55)49-37(27(2)3)31(8)47(61)63-32(9)43(57)54-25-17-22-36(54)48(62)64-40(28(4)5)46(60)51(39)10/h12-14,18-19,27-32,34-40H,11,15-17,20-26H2,1-10H3,(H,49,55)(H,50,56)/t29-,30+,31+,32-,34+,35+,36+,37+,38+,39-,40-/m1/s1
SMILES C1CN2[C@@H](C1)C(=O)O[C@H](C(C)C)C(=O)N([C@@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)N3[C@H](C(=O)N[C@H]([C@H](C)C(=O)O[C@@H](C2=O)C)C(C)C)CCC3)[C@@H](C)Cc2ccccc2)CCC1)[C@@H](CC)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
--Lyngbya majuscula Ref.
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