Compound Summary
Compound Information
Malonoben
Compound Name: | Malonoben |
Compound CID: | 5614 |
Synonyms: | Malonoben tyrphostin A9 10537-47-0 Tyrphostin 9 2-(3,5-Di-tert-butyl-4-hydroxybenzylidene)malononitrile More... |
Iupac Name: | 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]propanedinitrile |
InChI: | InChI=1S/C18H22N2O/c1-17(2,3)14-8-12(7-13(10-19)11-20)9-15(16(14)21)18(4,5)6/h7-9,21H,1-6H3 |
InChIKey: | MZOPWQKISXCCTP-UHFFFAOYSA-N |
Canonical Smiles: | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)C#N |
Isomeric Smiles: | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)C#N |
Molecular Weight: | 282.4 |
Molecular Formula: | C18H22N2O |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Malonoben
Molecular Weight: | 282.4 |
Molecular Formula: | C18H22N2O |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 21 |
Complexity: | 459 |
Synonyms
Malonoben
| Malonoben | Malonoben |
|---|---|
Malonoben |
tyrphostin A9 |
10537-47-0 |
Tyrphostin 9 |
2-(3,5-Di-tert-butyl-4-hydroxybenzylidene)malononitrile |
NSC 242557 |
GCP 5126 |
ENT 27910 |
SF 6847 |
AG 17 |
UNII-87TE8MRS65 |
RG-50872 |
(3,5-Di-t-butyl-4-hydroxybenzylidene)malononitrile |
Tyrphostin 9 (RG-50872, Malonaben, SF 6847) |
S-15126 |
3,5-di-t-Butyl-4-hydroxy-benzylidenemalononitrile |
MLS002702095 |
87TE8MRS65 |
CHEBI:82168 |
2-(3,5-ditert-butyl-4-hydroxyphenyl)methylidenepropanedinitrile |
GCP5126 |
2-(3,5-di-tert-butyl-4-hydroxyphenyl)methylidenepropanedinitrile |
MFCD00209853 |
NSC242557 |
Propanedinitrile, 2-((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)- |
Malonoben ANSI |
3,5-Di-tert-butyl-4-hydroxybenzilidenemalononitrile |
(3,5-Di-tert-butyl-4-hydroxy-benzylidene)malononitrile |
(3,5-di-tert-butyl-4-hydroxybenzylidene)propanedinitrile |
Caswell No. 291AA |
2-3,5-bis(1,1-dimethylethyl)-4-hydroxyphenylmethylene-propanedinitrile |
Gulf S-15126 |
SMR001230759 |
Malonoben ANSI:ISO |
EPA Pesticide Chemical Code 537200 |
BRN 2700764 |
Malonaben |
AI3-27910 |
tyrphostin-A9 |
propanedinitrile, 2-3,5-bis(1,1-dimethylethyl)-4-hydroxyphenylmethylene- |
Tyrphostin AG 17 |
Tyrphostin 9AG-17 |
Tyrphostin A9, solid |
TYRPHOSTINA9 |
Lopac-T-182 |
BiomolKI_000020 |
2-((3,5-Bis(1,1-dimethyl)-4-hydroxyphenyl)methylene)propanedinitrile |
BiomolKI2_000009 |
2-((3,5-bis(1,1-Dimethylethyl)-4-hydroxyphenyl)methylene)propanedinitrile |
Propanedinitrile, ((3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl)methylene)- |
Neuro_000115 |
CBiol_001719 |
Lopac0_001254 |
Oprea1_168738 |
BMK1-C8 |
BSPBio_001200 |
KBioGR_000540 |
KBioSS_000540 |
4-10-00-02178 (Beilstein Handbook Reference) |
MLS002153354 |
CHEMBL78150 |
SCHEMBL120440 |
TYRPHOSTIN 9, AG-9 |
Tyrphostin 9 (SF 6847) |
AG17 |
alpha-Cyano-(3,5-di-t-butyl-4-hydroxy)cinnamonitrile |
BDBM4325 |
ZINC5256 |
DTXSID1042106 |
KBio2_000540 |
KBio2_003108 |
KBio2_005676 |
KBio3_000979 |
KBio3_000980 |
Bio1_000005 |
Bio1_000494 |
Bio1_000983 |
Bio2_000440 |
Bio2_000920 |
HMS1362L21 |
HMS1792L21 |
HMS1990L21 |
HMS2232D08 |
HMS3263L10 |
HMS3371F08 |
HMS3403L21 |
HMS3651J06 |
MALONONITRILE, 3,5-DI-tert-BUTYL-4-HYDROXYBENZYLIDENE- |
2-(3,5-ditert-butyl-4-hydroxy-phenyl)methylenepropanedinitrile |
BCP06486 |
Malononitrile, (3,5-di-tert-butyl-4-hydroxybenzylidene)- (8CI) |
Tox21_501254 |
HSCI1_000185 |
MCK103008 |
s2895 |
STL406446 |
3,5-bis(1,1-Dimethylethyl)-4-hydroxyphenylmethylenepropanedinitrile |
AKOS024319213 |
Propanedinitrile,2-3,5-bis(1,1-dimethylethyl)-4-hydroxyphenylmethylene- |
CCG-100624 |
CS-1033 |
LP01254 |
MCULE-2226202492 |
NSC-242557 |
QC-1143 |
SDCCGSBI-0051221.P002 |
SF-6847 |
IDI1_002195 |
benzylidenemalononitrile (BMN) deriv. 9 |
NCGC00015992-01 |
NCGC00015992-02 |
NCGC00015992-03 |
NCGC00015992-04 |
NCGC00015992-05 |
NCGC00015992-06 |
NCGC00015992-07 |
NCGC00094494-01 |
NCGC00094494-02 |
NCGC00094494-03 |
NCGC00094494-04 |
NCGC00094494-05 |
NCGC00261939-01 |
AC-32053 |
HY-15511 |
LS-14656 |
NCI60_001943 |
SF 6847;RG-50872 |
AB0035909 |
EU-0101254 |
SW219498-1 |
T-182 |
Y0356 |
A11949 |
C19039 |
N10851 |
2,6-Di-tert-butyl-4-(2,2-dicyanovinyl)phenol |
AG 17 - CAS 10537-47-0 |
SR-01000075534 |
J-001407 |
J-524054 |
Malononitrile,5-di-tert-butyl-4-hydroxybenzylidene- |
SR-01000075534-1 |
3,5-di-tert-butyl-4-hydroxybenzylidene-malononitrile |
BRD-K40255344-001-04-4 |
BRD-K40255344-001-05-1 |
Q27155778 |
(3,5-di-tert-butyl-4-hydroxybenzylidene)-Malononitrile |
2-(3,5-Di-tert-butyl-4-hydroxy-benzylidene)-malononitrile |
2-3,1-dimethyl)-4-hydroxyphenylmethylenepropanedinitrile |
2-3,1-dimethylethyl)-4-hydroxyphenylmethylenepropanedinitrile |
3,5-bis(1,1-Dimethylethyl)-4-hydroxyphenylmethylene-propanedinitrile |
Propanedinitrile,5-bis(1,1-dimethylethyl)-4-hydroxyphenylmethylene- |
3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenylmethylenepropanedinitrile, 9CI |
Experimental Data
Malonoben
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Drosophila melanogaster | 17.3 | S | Oregon-R | 22363408 | Active | ||||||||
| Caenorhabditis elegans | 33 | umol/L | -95 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Malonoben
Statistics Data
Malonoben
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -95 | 1 | 1 | |
| Drosophila melanogaster | 17.3 | 1 | 1 |
Statistics Data Visualization
Malonoben
