CAS 21339-55-9|(S)-Indoximod

Introduction:Basic information about CAS 21339-55-9|(S)-Indoximod, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name(S)-Indoximod
CAS Number21339-55-9Molecular Weight218.252
Density1.28Boiling Point429.3±35.0 °C at 760 mmHg
Molecular FormulaC12H14N2O2Melting Point223-226 ºC
MSDSChineseUSAFlash Point213.4±25.9 °C

Names

Name(2S)-2-amino-3-(1-methylindol-3-yl)propanoic acid
SynonymMore Synonyms

(S)-Indoximod BiologicalActivity

Description(S)-Indoximod (1-Methyl-L-tryptophan) is an inhibitor of indoleamine 2,3-dioxygenase (IDO). (S)-Indoximod can be used for the research of cancer[1][2].
Related CatalogResearch Areas >>CancerSignaling Pathways >>Metabolic Enzyme/Protease >>Indoleamine 2,3-Dioxygenase (IDO)
Target

Indoleamine 2,3-Dioxygenase (IDO)[1]

References

[1]. Huang GL, et, al. PEG-Poly(1-Methyl-l-Tryptophan)-Based Polymeric Micelles as Enzymatically Activated Inhibitors of Indoleamine 2,3-Dioxygenase. Nanomaterials (Basel). 2019 May 9;9(5):719.

[2]. Liu X, et, al. 1-L-MT, an IDO inhibitor, prevented colitis-associated cancer by inducing CDC20 inhibition-mediated mitotic death of colon cancer cells. Int J Cancer. 2018 Sep 15;143(6):1516-1529.

Chemical & Physical Properties

Density1.28
Boiling Point429.3±35.0 °C at 760 mmHg
Melting Point223-226 ºC
Molecular FormulaC12H14N2O2
Molecular Weight218.252
Flash Point213.4±25.9 °C
Exact Mass218.105530
PSA68.25000
LogP1.43
Vapour Pressure0.0±1.1 mmHg at 25°C
Index of Refraction1.625
InChIKeyZADWXFSZEAPBJS-JTQLQIEISA-N
SMILESCn1cc(CC(N)C(=O)O)c2ccccc21
Storage condition2-8°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YN7135000
CHEMICAL NAME :
L-Tryptophan, 1-methyl-
CAS REGISTRY NUMBER :
21339-55-9
LAST UPDATED :
198910
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H14-N2-O2
MOLECULAR WEIGHT :
218.28

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
286 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JTEHD6 Journal of Toxicology and Environmental Health. (Hemisphere Pub., 1025 Vermont Ave., NW, Washington, DC 20005) V.1- 1975/76- Volume(issue)/page/year: 1,515,1976

Safety Information

Personal Protective EquipmentEyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard CodesXn
Risk PhrasesR20/21/22
Safety Phrases36
RIDADRNONH for all modes of transport
WGK Germany3
RTECSYN7135000
HS Code2933990090

Customs

HS Code2933990090
Summary2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Synonyms

1-Methyl-L-tryptophan
DL-1-Methyltryptophan
MFCD00467133
L-Tryptophan, 1-methyl-
1-methyl-(D,L)-tryptophan
1-Methyl-L-tryptophane
H-L-Trp(N-CH3)-OH
H-Trp(1-Me)-OH
BIDD:GT0440
(S)-2-Amino-3-(1-methyl-1H-indol-3-yl)propanoic acid
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