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(Q77377830)
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English
Ambiguine G nitrile
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
13-Chloro-12-ethenyl-8,8,12,19,19-pentamethyl-6-azapentacyclo[13.3.1.05,18.07,17.011,16]nonadeca-1(18),2,4,7(17),9,11(16)-hexaene-9-carbonitrile
1 reference
based on heuristic
inferred from SMILES
mass
402.186276544
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₂₇ClN₂
0 references
canonical SMILES
N#CC1=CC2=C3C=4C=5C(=CC=CC5C(C)(C)C3CC(Cl)C2(C=C)C)NC4C1(C)C
0 references
isomeric SMILES
C=C[C@]1(C)C2=C3c4c([nH]c5cccc(c45)C(C)(C)[C@H]3C[C@H]1Cl)C(C)(C)C(C#N)=C2
0 references
found in taxon
Hapalosiphon delicatulus
1 reference
stated in
Isolation of a nitrile-containing indole alkaloid from the terrestrial blue-green alga hapalosiphon delicatulus
Identifiers
InChI
InChI=1S/C26H27ClN2/c1-7-26(6)17-11-14(13-28)24(2,3)23-22-20(17)16(12-19(26)27)25(4,5)15-9-8-10-18(29-23)21(15)22/h7-11,16,19,29H,1,12H2,2-6H3/t16-,19+,26+/m0/s1
0 references
InChIKey
HFHQOKOLRORURO-KGVVXCLESA-N
2 references
stated in
PubChem
PubChem CID
10834980
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10834980
language of work or name
English
PubChem CID
10834980
2 references
stated in
PubChem
PubChem CID
10834980
language of work or name
English
matched by identifier from
InChIKey
InChIKey
HFHQOKOLRORURO-KGVVXCLESA-N
ChEBI ID
203453
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C26H27ClN2/c1-7-26(6)17-11-14(13-28)24(2,3)23-22-20(17)16(12-19(26)27)25(4,5)15-9-8-10-18(29-23)21(15)22/h7-11,16,19,29H,1,12H2,2-6H3/t16-,19+,26+/m0/s1
UniChem compound ID
31988071
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID801335151
1 reference
matched by identifier from
InChIKey
InChIKey
HFHQOKOLRORURO-KGVVXCLESA-N
Natural Product Atlas ID
NPA006411
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HFHQOKOLRORURO-KGVVXCLESA-N
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