input word = C00044096

Metabolite InformationStructural formula
Name Ascaulitoxin
(-)-Ascaulitoxin
Formula C14H27N3O10
Mw 397.16964411
CAS RN 212268-55-8
C_ID C00044096 ,
InChIKey RETMXMAOYGZCRA-BDPKHRBCNA-N
InChICode InChI=1S/C14H27N3O10/c15-4(7(19)2-5(16)13(23)24)1-6(14(25)26)17-12-11(22)10(21)9(20)8(3-18)27-12/h4-12,17-22H,1-3,15-16H2,(H,23,24)(H,25,26)/t4-,5+,6+,7+,8-,9-,10+,11-,12-/m1/s1
SMILES [C@H](N)(C[C@H](O)[C@@H](C[C@H](N[C@H]1[C@H](O)[C@H]([C@@H]([C@H](O1)CO)O)O)C(=O)O)N)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
FungiIncertae sedisAscochyta caulina Ref.
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