input word = C00017868

Metabolite InformationStructural formula
Name Leucinostatin K
Formula C62H111N11O14
Mw 1233.83119733
CAS RN 109539-57-3
C_ID C00017868 ,
InChIKey QAJHIWCONAFMCM-UHFFFAOYNA-N
InChICode InChI=1S/C62H111N11O14/c1-21-38(9)23-24-49(77)72-33-40(11)31-47(72)55(82)66-46(30-39(10)29-43(75)32-42(74)22-2)53(80)68-50(51(78)37(7)8)56(83)70-61(15,16)58(85)67-44(27-35(3)4)52(79)65-45(28-36(5)6)54(81)69-62(17,18)59(86)71-60(13,14)57(84)63-26-25-48(76)64-41(12)34-73(19,20)87/h23-24,35-41,43-47,50-51,75,78H,21-22,25-34H2,1-20H3,(H,63,84)(H,64,76)(H,65,79)(H,66,82)(H,67,85)(H,68,80)(H,69,81)(H,70,83)(H,71,86)/b24-23+/t38-,39+,40+,41+,43+,44+,45+,46-,47+,50-,51-/m1/s1
SMILES [C@H]([C@H](O)C(C)C)(NC(=O)[C@@H](C[C@@H](C)C[C@H](O)CC(=O)CC)NC(=O)[C@H]1N(C[C@H](C1)C)C(=O)/C=C/[C@H](C)CC)C(=O)NC(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NC(C(=O)NC(C(=O)NCCC(=O)N[C@@H](C)CN(=O)(C)C)(C)C)(C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Ala
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePaecilomyces marquandii Ref.
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