CAS 101141-95-1 Foslevodopa (HCID 127766)

基本情報

CAS: 101141-95-1
標準SMILES: N[C@@H](Cc1ccc(OP(=O)(O)O)c(O)c1)C(=O)O
InChIKey: YNDMEEULGSTYJT-LURJTMIESA-N
分子式: C9H12NO7P
平均分子量: 277.17 g/mol
単同位体質量: 277.03513835

概要

Foslevodopa is an L-tyrosine derivative that is L-dopa in which the hydroxy group at position 4' is replaced by a phosphonooxy group. It is a water-soluble prodrug of levodopa which is used for the treatment of Parkinson's disease. It has a role as an antiparkinson drug and a prodrug. It is an O-phosphoamino acid, a L-tyrosine derivative and a non-proteinogenic L-alpha-amino acid. It is functionally related to a L-dopa.

名称と識別子

優先名称: Foslevodopa
IUPAC: (2S)-2-amino-3-(3-hydroxy-4-phosphonooxyphenyl)propanoic acid
英語名: DOPA 4-phosphate
分子式: C9H12NO7P
分子量: 277.167841

名称と別名

Foslevodopa97321-87-4Levodopa-4'-monophosphate3-hydroxy-O-phosphono-L-tyrosineFoslevodopa [USAN](2S)-2-amino-3-(3-hydroxy-4-phosphonooxyphenyl)propanoic acid37NQZ0J76IFOSLEVODOPA [INN]FOSLEVODOPA [JAN]ABBV-951 COMPONENT FOSLEVODOPAL-TYROSINE, 3-HYDROXY-O-PHOSPHONO-L-TYROSINE, 3-HYDROXY-, 4-(DIHYDROGEN PHOSPHATE)

名称をさらに表示

DOPA 4-PHOSPHONATE

foslevodopumRefChem:600352Dopa 4-phosphateABBV-951101141-95-1UNII-37NQZ0J76IWHO 11006(S)-2-amino-3-(3-hydroxy-4-(phosphonooxy)phenyl)propanoic acid

データベース識別子

CAS: 101141-95-1、97321-87-4
PubChem CID: 127766
DTXSID: DTXSID70905957
ChEMBL: CHEMBL4594379
ChEBI: CHEBI:192509
UNII: 37NQZ0J76I
Nikkaji: J3.795.603A

物性

構造計算による物性

XLogP: -4
極性表面積: 150 Å²
水素結合供与体数: 5
水素結合受容体数: 8
回転可能結合数: 5
重原子数: 18
形式電荷: 0
複雑度: 344

実験および物理化学的性質

Human Drugs · 2 件

FDA approved drugs -> Active ingredient

化学と産業

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上海沛灵生物科技有限公司13127581762 13127581762 · [email protected]

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合肥天瑞药物化学有限公司0551-68933033 13956024211

Chongqing jooe co., ltd+86-15223382610 · [email protected]

上海陶术生物科技股份有限公司13564774135 · [email protected]

化合物ノート

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