Aminolevulinic acid phosphate

HCID 24737828

노트 반응

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기본 정보

CAS: 868074-65-1
표준 SMILES: NCC(=O)CCC(=O)O.O=P(O)(O)O
InChIKey: XWNWBYZHOAIHTK-UHFFFAOYSA-N
분자식: C5H12NO7P
평균 분자량: 229.13 g/mol
단동위원소 질량: 229.03513835

이름 및 식별자

우선 이름: Aminolevulinic acid phosphate
IUPAC: 5-amino-4-oxopentanoic acid;phosphoric acid
영어명: Aminolevulinic acid phosphate
분자식: C5H12NO7P
분자량: 229.125041

이름 및 동의어

Aminolevulinic acid phosphate868074-65-15-Aminolevulinic acid phosphatePentanoic acid, 5-amino-4-oxo-, phosphate (1:1)UNII-FM8DCR39GHFM8DCR39GHdelta-Aminolevulinic acid phosphateAminolevulinic acid phosphate [INCI]DTXSID70235827.DELTA.-AMINOLEVULINIC ACID PHOSPHATEAMINOLEVULINIC ACID PHOSPHATE [WHO-DD]RefChem:112045

이름 더 보기

5-ALA phosphate5-Aminolevulinic acid (phosphote)5-amino-4-oxopentanoic acid,ph...5-Aminolevulinic acid phosphate（ALA ）5-Aminolevulinic Acid Phosphate (5-ALA)ALA Synonyms：5-Aminolevulinic acid phosphate

DTXCID001583185-Amino-4-oxopentanoic acid phosphate5-amino-4-oxopentanoic acid;phosphoric acid5-Amino-4-oxopentanoic acid--phosphoric acid (1/1)5-amino-4-oxopentanoic acid,phosphoric acidC5H12NO7PSCHEMBL2113147XWNWBYZHOAIHTK-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 868074-65-1
PubChem CID: 24737828
DTXSID: DTXSID70235827
UNII: FM8DCR39GH

물성

구조 계산 물성

극성 표면적: 158 Å²
수소 결합 공여자 수: 5
수소 결합 수용자 수: 8
회전 가능 결합 수: 4
무거운 원자 수: 14
형식 전하: 0
복잡도: 171

물리화학적 성질

화장품 원료 기능: 보습제
InChI: InChI=1S/C5H9NO3.H3O4P/c6-3-4(7)1-2-5(8)9;1-5(2,3)4/h1-3,6H2,(H,8,9);(H3,1,2,3,4)
InChIKey: XWNWBYZHOAIHTK-UHFFFAOYSA-N
SMILES: C(O)(=O)CCC(=O)CN.P(O)(O)(O)=O

화학 및 산업

응용 분야 · 1건

개요Aminolevulinic acid phosphate is a topically administered metabolic precursor of protoporphyrin IX. After topical administration, aminolevulinic acid (ALA) is converted to protoporphyrin IX (PpIX), a photosensitizer. When the proper wavelength of light activates protoporphyrin IX, singlet oxygen is produced, resulting in a local cytotoxic effect.