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(Q105277943)
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English
N'-({[(3Z)-5-(hydroxymethyl)indol-3-ylidene]methyl}amino)-N-pentylguanidine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
indole alkaloid
0 references
mass
301.190260356
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₃N₅O
0 references
canonical SMILES
N=C(NNC=C1C=NC=2C=CC(=CC21)CO)NCCCCC
0 references
isomeric SMILES
CCCCCNC(=N)NN/C=C1\C=Nc2ccc(CO)cc21
1 reference
based on heuristic
inferred from InChI
found in taxon
Geodia barretti
1 reference
stated in
Brominated cyclodipeptides from the marine sponge Geodia barretti as selective 5-HT ligands
Identifiers
InChI
InChI=1S/C16H23N5O/c1-2-3-4-7-18-16(17)21-20-10-13-9-19-15-6-5-12(11-22)8-14(13)15/h5-6,8-10,20,22H,2-4,7,11H2,1H3,(H3,17,18,21)/b13-10+
0 references
InChIKey
URPUECXJHQGUDU-JLHYYAGUSA-N
0 references
PubChem CID
5487301
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
SureChEMBL ID
SCHEMBL16465
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
URPUECXJHQGUDU-JLHYYAGUSA-N
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