input word = C00027916

Metabolite InformationStructural formula
Name Barbaleucamide A
Formula C16H20Cl6N2O2S
Mw 513.93766489
CAS RN 364321-10-8
C_ID C00027916 ,
InChIKey ZQNZRXUXPBMKEO-SCQJVJCJNA-N
InChICode InChI=1S/C16H20Cl6N2O2S/c1-9(15(17,18)19)6-11(26-3)8-13(25)24-12(14-23-4-5-27-14)7-10(2)16(20,21)22/h4-5,8-10,12H,6-7H2,1-3H3,(H,24,25)/b11-8+/t9-,10-,12-/m0/s1
SMILES c1csc(n1)[C@@H](NC(=O)/C=C(/OC)\C[C@H](C)C(Cl)(Cl)Cl)C[C@@H](C(Cl)(Cl)Cl)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Asp L-Phe L-His
Organism
Kingdom Family Species Reference
--Dysidea herbacea sp.1524 Ref.
--Dysidea sp. Ref.
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OrganismDysidea sp.
ReferenceHarrigan,J.Nat.Prod.,64,(2001),1133