input word = C00017600

Metabolite InformationStructural formula
Name Cepafungin III
Formula C26H42N4O6
Mw 506.3104351
CAS RN 130743-09-8
C_ID C00017600 ,
InChIKey ZQOSECHKDTUIEK-PGYHMIPMNA-N
InChICode InChI=1S/C26H42N4O6/c1-17(2)10-8-6-5-7-9-11-23(34)30-24(19(4)31)26(36)29-21-16-20(32)14-15-27-22(33)13-12-18(3)28-25(21)35/h5,7,9,11-13,17-21,24,31-32H,6,8,10,14-16H2,1-4H3,(H,27,33)(H,28,35)(H,29,36)(H,30,34)/b7-5-,11-9+,13-12-/t18-,19+,20+,21+,24+/m0/s1
SMILES [C@H]1(CCNC(=O)/C=C\[C@@H](NC(=O)[C@@H](C1)NC(=O)[C@H](NC(=O)/C=C/C=C\CCCC(C)C)[C@H](O)C)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg
Organism
Kingdom Family Species Reference
BacteriaPseudomonadaceaePseudomonas sp. CB-3 Ref.
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