Compound Summary
Compound Information
THIORPHAN
Compound Name: | THIORPHAN |
Compound CID: | 3132 |
Synonyms: | THIORPHAN dl-thiorphan 76721-89-6 2-(2-benzyl-3-sulfanylpropanoyl)aminoacetic acid DL-3-Mercapto-2-benzylpropanoylglycine More... |
Iupac Name: | 2-[(2-benzyl-3-sulfanylpropanoyl)amino]acetic acid |
InChI: | InChI=1S/C12H15NO3S/c14-11(15)7-13-12(16)10(8-17)6-9-4-2-1-3-5-9/h1-5,10,17H,6-8H2,(H,13,16)(H,14,15) |
InChIKey: | LJJKNPQAGWVLDQ-UHFFFAOYSA-N |
Canonical Smiles: | C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)O |
Isomeric Smiles: | C1=CC=C(C=C1)CC(CS)C(=O)NCC(=O)O |
Molecular Weight: | 253.32 |
Molecular Formula: | C12H15NO3S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
THIORPHAN
Molecular Weight: | 253.32 |
Molecular Formula: | C12H15NO3S |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 6 |
Heavy Atom Count: | 17 |
Complexity: | 265 |
Synonyms
THIORPHAN
| THIORPHAN | THIORPHAN |
|---|---|
THIORPHAN |
dl-thiorphan |
76721-89-6 |
2-(2-benzyl-3-sulfanylpropanoyl)aminoacetic acid |
DL-3-Mercapto-2-benzylpropanoylglycine |
CHEMBL10247 |
(DL-3-Mercapto-2-benzylpropanoyl)-Gly-OH |
CHEBI:9568 |
2-(2-Benzyl-3-mercaptopropanamido)acetic acid |
Glycine, N-(2-(mercaptomethyl)-1-oxo-3-phenylpropyl)-, (+-)- |
MFCD00058435 |
SR-01000076164 |
n-(2-benzyl-3-sulfanylpropanoyl)glycine |
Prestwick_694 |
(+/-)-Thiorphan |
ACMC-20eo1l |
Prestwick0_000633 |
Prestwick1_000633 |
Prestwick2_000633 |
Prestwick3_000633 |
N-(RS)-2-Benzyl-3-mercaptopropanoyl-glycine |
Lopac0_001139 |
BSPBio_000626 |
BSPBio_001543 |
KBioGR_000263 |
KBioSS_000263 |
MLS002153923 |
SCHEMBL401174 |
SPBio_002845 |
BPBio1_000690 |
BDBM21641 |
KBio2_000263 |
KBio2_002831 |
KBio2_005399 |
KBio3_000525 |
KBio3_000526 |
DTXSID70868412 |
Bio2_000263 |
Bio2_000743 |
DL-Thiorphan, >=98% (TLC) |
HMS1361N05 |
HMS1569P08 |
HMS1791N05 |
HMS1989N05 |
HMS2096P08 |
HMS2230G03 |
HMS3263D19 |
HMS3373F16 |
HMS3402N05 |
HMS3713P08 |
Tox21_501139 |
NSC727676 |
AKOS024257670 |
CCG-205213 |
FD21637 |
LP01139 |
NSC 727676 |
NSC-727676 |
SDCCGSBI-0051106.P003 |
IDI1_034013 |
SMP2_000064 |
DL-Thiorphan - CAS 76721-89-6 |
N-(2-Benzyl-3-mercaptopropanoyl)glycine |
NCGC00016033-02 |
NCGC00016033-03 |
NCGC00016033-04 |
NCGC00016033-05 |
NCGC00016033-06 |
NCGC00016033-11 |
NCGC00094405-01 |
NCGC00094405-02 |
NCGC00094405-03 |
NCGC00094405-04 |
NCGC00261824-01 |
AS-79321 |
SMR001233267 |
EU-0101139 |
FT-0675192 |
2-(2-benzyl-3-sulfanylpropanamido)acetic acid |
C01619 |
T 6031 |
(+/-)-N-(3-Mercapto-2-benzylpropionyl)glycine |
Q7784695 |
SR-01000076164-1 |
SR-01000076164-5 |
2-(2-benzyl-3-sulfanyl-propanoyl)aminoacetic acid |
BRD-A56012032-001-06-4 |
Racecadotril active metabolite|||Acetorphan active metabolite |
Experimental Data
THIORPHAN
| 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 | 8 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
THIORPHAN
Statistics Data
THIORPHAN
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 8 | 1 | 1 |
Statistics Data Visualization
THIORPHAN
