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(Q105002966)
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English
clathramide D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-[(4-bromo-1H-pyrrole-2-carbonyl)amino]-3-(5-methyl-1,4-dihydroimidazol-5-yl)propanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
342.03275244
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
clathramide C
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₂H₁₅BrN₄O₃
0 references
canonical SMILES
O=C(O)C(NC(=O)C1=CC(Br)=CN1)CC2(NC=NC2)C
0 references
isomeric SMILES
C[C@]1(C[C@@H](NC(=O)c2cc(Br)c[nH]2)C(=O)O)CN=CN1
0 references
found in taxon
Agelas dispar
2 references
stated in
Novel bromopyrrole alkaloids from the sponge Agelas dispar
stated in
New bromopyrrole alkaloids from the marine sponge Agelas sp.
Identifiers
InChI
InChI=1S/C12H15BrN4O3/c1-12(5-14-6-16-12)3-9(11(19)20)17-10(18)8-2-7(13)4-15-8/h2,4,6,9,15H,3,5H2,1H3,(H,14,16)(H,17,18)(H,19,20)/t9-,12+/m1/s1
0 references
InChIKey
FVXSWNCEYOEDFV-SKDRFNHKSA-N
0 references
PubChem CID
10783554
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
10783555
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
387322
1 reference
stated in
UniChem
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