input word = C00016415

Metabolite InformationStructural formula
Name Diheteropeptin
Formula C28H42N4O6
Mw 530.3104351
CAS RN 202869-98-5
C_ID C00016415 ,
InChIKey NAOMMKDKLCMCHA-LKLHISDKNA-N
InChICode InChI=1S/C28H42N4O6/c1-18(33)23(34)15-9-5-8-13-20-24(35)31-28(2,3)27(38)30-21(17-19-11-6-4-7-12-19)26(37)32-16-10-14-22(32)25(36)29-20/h4,6-7,11-12,18,20-23,33-34H,5,8-10,13-17H2,1-3H3,(H,29,36)(H,30,38)(H,31,35)/t18-,20+,21+,22-,23-/m1/s1
SMILES N1C(C(=O)N[C@H](C(=O)N2[C@@H](C(=O)N[C@H](C1=O)CCCCC[C@H]([C@@H](C)O)O)CCC2)Cc1ccccc1)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
--Dihelerispora chlamycosporia Ref.
--Diheterospora sp. Ref.
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