Compound Summary


79558-09-1
  Compound Information
 79558-09-1

Compound Name:

79558-09-1

Compound CID:

6603901

Synonyms:

79558-09-1

L-165041

L-165,041

2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy)phenoxy)acetic acid

L165041

More...

Iupac Name:

2-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy]acetic acid

InChI:

InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25)

InChIKey:

HBBVCKCCQCQCTJ-UHFFFAOYSA-N

Canonical Smiles:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=C(C=C2)OCC(=O)O

Isomeric Smiles:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=C(C=C2)OCC(=O)O

Molecular Weight:

402.4

Molecular Formula:

C22H26O7

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 79558-09-1

Molecular Weight:

402.4

Molecular Formula:

C22H26O7

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

7

Rotatable Bond Count:

12

Heavy Atom Count:

29

Complexity:

501

  Synonyms
 79558-09-1

79558-09-1 79558-09-1

79558-09-1

L-165041

L-165,041

2-(4-(3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy)phenoxy)acetic acid

L165041

2-(4-(3-(4-Acetyl-3-hydroxy-2-propylphenoxy)-propoxy)phenoxy)acetic acid

4-3-(4-Acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxy-acetic acid

L 165041

Aceticacid, 2-4-3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxy-

CHEMBL153057

{4-3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxy}acetic acid

2-4-3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxyacetic acid

4-3-(4-Acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxyacetic acid

2-4-3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxy-acetic acid

SR-01000075922

NCGC00015599-01

Lopac-L-2167

4-(3-(2-propyl-3-hydroxy-4-acetyl)phenoxy)propyloxyphenoxy acetic acid

4-3-(2-Propyl-3-hydroxy-4-acetyl)phenoxypropyloxyphenoxy-acetic acid

DSSTox_CID_20745

DSSTox_RID_79585

DSSTox_GSID_40745

Lopac0_000617

MLS002172459

GTPL2691

QCR-75

SCHEMBL2067483

DTXSID6040745

CHEBI:94812

AOB6776

HMS2234I08

HMS3261L16

HMS3369O13

HMS3750G17

BCP06752

EX-A3586

ZINC2541693

Tox21_302413

Tox21_500617

4-3-(4-Acetyl-3-hydroxy-2-propylphenoxy)propoxyphenoxyaceticacid

BDBM50085041

MFCD04974501

AKOS016004395

CCG-204706

CS-0826

DB08078

LP00617

SDCCGSBI-0050599.P002

NCGC00015599-02

NCGC00015599-03

NCGC00015599-04

NCGC00015599-05

NCGC00015599-11

NCGC00093991-01

NCGC00093991-02

NCGC00093991-03

NCGC00255669-01

NCGC00261302-01

AC-32622

HY-20019

SMR001254092

AB0033317

CAS-79558-09-1

EU-0100617

X6845

EC-000.2412

L 2167

L-165,041, >=98% (HPLC), powder

SR-01000075922-1

SR-01000075922-4

Q15708302

L-165,041 - CAS 79558-09-1

{4-3-(4-Acetyl-3-hydroxy-2-propyl-phenoxy)-propoxy-phenoxy}-acetic acid(L-165041)

242149-08-2

L41

  Experimental Data
 79558-09-1

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Caenorhabditis elegans 33.000000000000000 umol/L 21.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 79558-09-1

  Statistics Data
 79558-09-1

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 21.000000000000000 1 1
  Statistics Data Visualization
 79558-09-1