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(Q104399406)
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English
ambiguine A isonitrile
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(2S,4R,5R,7S)-5-chloro-4-ethenyl-3-isocyano-4,8,8-trimethyl-15-(2-methylbut-3-en-2-yl)-14-azatetracyclo[7.6.1.0²,⁷.0¹³,¹⁶]hexadeca-1(15),9(16),10,12-tetraene
1 reference
based on heuristic
inferred from SMILES
mass
406.217576672
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₃₁ClN₂
0 references
canonical SMILES
[C-]#[N+]C1C2C=3C=4C(=CC=CC4C(C)(C)C2CC(Cl)C1(C=C)C)NC3C(C=C)(C)C
0 references
isomeric SMILES
[C-]#[N+][C@@H]1[C@@H]2c3c(C(C)(C)C=C)[nH]c4cccc(c34)C(C)(C)[C@H]2C[C@@H](Cl)[C@]1(C)C=C
0 references
found in taxon
Fischerella
2 references
stated in
Antimicrobial Ambiguines from the Cyanobacterium Fischerella sp. Collected in Israel
stated in
Antimicrobial ambiguines from the cyanobacterium Fischerella sp. collected in Israel
Hapalosiphon delicatulus
1 reference
stated in
Isolation of a nitrile-containing indole alkaloid from the terrestrial blue-green alga hapalosiphon delicatulus
Fischerella ambigua
2 references
stated in
Ambiguine isonitriles, fungicidal hapalindole-type alkaloids from three genera of blue-green algae belonging to the Stigonemataceae
stated in
Antimicrobial ambiguine isonitriles from the cyanobacterium Fischerella ambigua
Identifiers
InChI
InChI=1S/C26H31ClN2/c1-9-24(3,4)22-21-19-15(12-11-13-17(19)29-22)25(5,6)16-14-18(27)26(7,10-2)23(28-8)20(16)21/h9-13,16,18,20,23,29H,1-2,14H2,3-7H3/t16-,18+,20-,23+,26-/m0/s1
0 references
InChIKey
GHYIJWADNLIVDB-UMIISBCRSA-N
0 references
PubChem CID
21610112
1 reference
matched by identifier from
InChIKey
InChIKey
GHYIJWADNLIVDB-UMIISBCRSA-N
ChEBI ID
229592
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C26H31ClN2/c1-9-24(3,4)22-21-19-15(12-11-13-17(19)29-22)25(5,6)16-14-18(27)26(7,10-2)23(28-8)20(16)21/h9-13,16,18,20,23,29H,1-2,14H2,3-7H3/t16-,18+,20-,23+,26-/m0/s1
UniChem compound ID
449851
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID601334890
1 reference
matched by identifier from
InChIKey
InChIKey
GHYIJWADNLIVDB-UMIISBCRSA-N
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