Compound Summary
Compound Information
IAA-94
Compound Name: | IAA-94 |
Compound CID: | 656717 |
Synonyms: | IAA-94 R(+)-IAA-94 54197-31-8 R(+)-Methylindazone (S)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)acetic acid More... |
Iupac Name: | 2-[[(2S)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-3H-inden-5-yl]oxy]acetic acid |
InChI: | InChI=1S/C17H18Cl2O4/c1-17(10-4-2-3-5-10)7-9-6-11(23-8-12(20)21)14(18)15(19)13(9)16(17)22/h6,10H,2-5,7-8H2,1H3,(H,20,21)/t17-/m0/s1 |
InChIKey: | RNOJGTHBMJBOSP-KRWDZBQOSA-N |
Canonical Smiles: | CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3CCCC3 |
Isomeric Smiles: | C[C@]1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3CCCC3 |
Molecular Weight: | 357.2 |
Molecular Formula: | C17H18Cl2O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
IAA-94
Molecular Weight: | 357.2 |
Molecular Formula: | C17H18Cl2O4 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 23 |
Complexity: | 491 |
Synonyms
IAA-94
| IAA-94 | IAA-94 |
|---|---|
IAA-94 |
R(+)-IAA-94 |
54197-31-8 |
R(+)-Methylindazone |
(S)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)acetic acid |
53108-01-3 |
CBiol_001794 |
R-(+)-laa-94 |
CHEBI:34794 |
2-(2S)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-3H-inden-5-yloxyacetic acid |
IAA 94/95; Indanyloxyacetic acid 94; MK 473 |
AC1LCVGT |
Lopac0_000674 |
BSPBio_001355 |
KBioGR_000075 |
KBioSS_000075 |
CHEMBL1406302 |
KBio2_000075 |
KBio2_002643 |
KBio2_005211 |
KBio3_000149 |
KBio3_000150 |
DTXSID40349647 |
2-(2R)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-3H-inden-5-yloxyacetic acid |
Bio1_000080 |
Bio1_000569 |
Bio1_001058 |
Bio2_000075 |
Bio2_000555 |
HMS1361D17 |
HMS1791D17 |
HMS1989D17 |
HMS3262G09 |
HMS3402D17 |
(R)-2-((6,7-Dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yl)oxy)acetic acid |
ZINC2003273 |
Tox21_500674 |
CCG-204760 |
LP00674 |
SB49372 |
SDCCGSBI-0050653.P002 |
IDI1_033825 |
NCGC00094034-01 |
NCGC00094034-02 |
NCGC00094034-03 |
NCGC00094034-04 |
NCGC00094034-05 |
NCGC00094034-06 |
NCGC00094034-07 |
NCGC00261359-01 |
EU-0100674 |
I-117 |
F50323 |
R(+)-Methylindazone; Indanyloxyacetic acid 94 |
SR-01000075322 |
SR-01000075322-1 |
BRD-K85383046-001-02-5 |
2-(2S)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-indan-5-yloxyacetic acid |
(S)-2-(6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-2,3-dihydro-1H-inden-5-yloxy)acetic acid |
R(+)-(6,7-Dichloro-2-cyclopentyl-2,3-dihydro-2-methyl-1-oxo-1H-inden-5-yl)-oxyacetic acid |
Experimental Data
IAA-94
| 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 | 33 | umol/L | -5 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
IAA-94
Statistics Data
IAA-94
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -5 | 1 | 1 |
Statistics Data Visualization
IAA-94
