Compound Summary


  Compound Information
 IMS2186

Compound Name:

IMS2186

Compound CID:

24987039

Synonyms:

IMS2186

1031206-36-6

IMS 2186

3-1-(3-Hydroxy-4-methoxyphenyl)-meth-(E)-ylidene-6-methyl-chroman-4-one

SCHEMBL4732781

More...

Iupac Name:

(3E)-3-[(3-hydroxy-4-methoxyphenyl)methylidene]-6-methylchromen-4-one

InChI:

InChI=1S/C18H16O4/c1-11-3-5-16-14(7-11)18(20)13(10-22-16)8-12-4-6-17(21-2)15(19)9-12/h3-9,19H,10H2,1-2H3/b13-8+

InChIKey:

BZCADTHMZLYKAR-MDWZMJQESA-N

Canonical Smiles:

CC1=CC2=C(C=C1)OCC(=CC3=CC(=C(C=C3)OC)O)C2=O

Isomeric Smiles:

CC1=CC2=C(C=C1)OC/C(=C\C3=CC(=C(C=C3)OC)O)/C2=O

Molecular Weight:

296.3

Molecular Formula:

C18H16O4

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 IMS2186

Molecular Weight:

296.3

Molecular Formula:

C18H16O4

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

2

Heavy Atom Count:

22

Complexity:

444

  Synonyms
 IMS2186

IMS2186 IMS2186

IMS2186

1031206-36-6

IMS 2186

3-1-(3-Hydroxy-4-methoxyphenyl)-meth-(E)-ylidene-6-methyl-chroman-4-one

SCHEMBL4732781

HMS3263I22

Tox21_501090

ZINC44018876

CCG-222394

LP01090

SDCCGSBI-0633787.P001

NCGC00261775-01

NCGC00386646-03

IMS2186, >=98% (HPLC), solid

J-000877

(E)-3-(3-hydroxy-4-methoxybenzylidene)-6-methylchroman-4-one

(3E)-3-(3-hydroxy-4-methoxyphenyl)methylidene-6-methylchromen-4-one

(3E)-2,3-Dihydro-3-(3-hydroxy-4-methoxyphenyl)methylene-6-methyl-4H-1-benzopyran-4-one

  Experimental Data
 IMS2186

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
Caenorhabditis elegans 100 umol/L 17.76 16.02 -9.809 NS N2 33008901 Inactive
Drosophila melanogaster 20 umol/L 49.36 48.88 -0.9693 NS FEMALES 33008901 Inactive
Drosophila melanogaster 200 umol/L 45.82 41.22 -10.04 NS MALES 33008901 Inactive
Caenorhabditis elegans 10 umol/L 16.58 15.71 -5.201 NS N2 33008901 Inactive
  Experimental Data Visualization
 IMS2186

  Statistics Data
 IMS2186

Species Lifespan Change(AVG/MED%) Lifespan Change(MAX%) Count Reference Count Data point
Caenorhabditis elegans -5.201 1 2
Drosophila melanogaster -0.9693 1 2
  Statistics Data Visualization
 IMS2186