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Coscinamide A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
tryptamine alkaloid
0 references
mass
407.026938788
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₄BrN₃O₂
0 references
canonical SMILES
O=C(NC=CC1=CNC=2C=C(Br)C=CC12)C(=O)C3=CNC=4C=CC=CC43
0 references
isomeric SMILES
O=C(N/C=C/c1c[nH]c2cc(Br)ccc12)C(=O)c1c[nH]c2ccccc12
1 reference
based on heuristic
inferred from InChI
found in taxon
Coscinoderma
1 reference
stated in
Coscinamides A, B and C, three new bis indole alkaloids from the marine sponge Coscinoderma sp.
Identifiers
InChI
InChI=1S/C20H14BrN3O2/c21-13-5-6-14-12(10-23-18(14)9-13)7-8-22-20(26)19(25)16-11-24-17-4-2-1-3-15(16)17/h1-11,23-24H,(H,22,26)/b8-7+
0 references
InChIKey
CNFDLPADVYGTJH-BQYQJAHWSA-N
0 references
PubChem CID
5352103
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CNFDLPADVYGTJH-BQYQJAHWSA-N
UniChem compound ID
33058110
1 reference
stated in
UniChem
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