 Home > Encyclopedia > 2-hydroxypropane-1,2,3-tricarboxylic acid;(2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[(5-oxooxolane-2-carbonyl)amino]propanoyl]pyrrolidine-2-carboxamide

2-hydroxypropane-1,2,3-tricarboxylic acid;(2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[(5-oxooxolane-2-carbonyl)amino]propanoyl]pyrrolidine-2-carboxamide

2-hydroxypropane-1,2,3-tricarboxylic acid;(2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[(5-oxooxolane-2-carbonyl)amino]propanoyl]pyrrolidine-2-carboxamide structure

CAS No:
77026-81-4
Formula:
C22H29N5O12
Chemical Name:
2-hydroxypropane-1,2,3-tricarboxylic acid;(2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[(5-oxooxolane-2-carbonyl)amino]propanoyl]pyrrolidine-2-carboxamide
Synonyms:
DN 1417;DN 1417 citrate (1:1);DN 1417, (S)-isomer;DN-1417;gamma-butyrolactone-gamma-carbonyl-His-ProNH2;gamma-butyrolactone-gamma-carbonyl-histidyl-prolinamide citrate;DN-1417;DN 1417;77026-81-4;(2S)-1-((5-oxotetrahydrofuran-2-carbonyl)-L-histidyl)pyrrolidine-2-carboxamide 2-hydroxypropane-1,2,3-tricarboxylate;SCHEMBL3095494;DTXSID30276458;Q27272636;gamma-Butyrolactone-gamma-carbonyl-histidyl-prolinamide citrate;96861-08-4;L-Prolinamide, N-((tetrahydro-5-oxo-2-furanyl)carbonyl)-L-histidyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)

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2-hydroxypropane-1,2,3-tricarboxylic acid;(2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[(5-oxooxolane-2-carbonyl)amino]propanoyl]pyrrolidine-2-carboxamide Basic Attributes

Molecular Weight：

555.5 g/mol

Exact Mass：

555.18127138 g/mol

DSSTox ID：

DTXSID30276458

Characteristics

PSA：

280 Å²

Drug Information

MeSH：

Drugs used to prevent SEIZURES or reduce their severity. (See all compounds classified as Anticonvulsants.)|Agents that control agitated psychotic behavior, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect. They are used in SCHIZOPHRENIA; senile dementia; transient psychosis following surgery; or MYOCARDIAL INFARCTION; etc. These drugs are often referred to as neuroleptics alluding to the tendency to produce neurological side effects, but not all antipsychotics are likely to produce such effects. Many of these drugs may also be effective against nausea, emesis, and pruritus. (See all compounds classified as Antipsychotic Agents.)

MeSH Entry Terms：

DN 1417

Computed Properties

Molecular Weight:555.5
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:11
Exact Mass:555.18127138
Monoisotopic Mass:555.18127138
Topological Polar Surface Area:280
Heavy Atom Count:39
Complexity:825
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-hydroxypropane-1,2,3-tricarboxylic acid;(2S)-1-[(2S)-3-(1H-imidazol-5-yl)-2-[(5-oxooxolane-2-carbonyl)amino]propanoyl]pyrrolidine-2-carboxamide

Basic Attributes
Characteristics
Drug Information
Computed Properties
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