Talaporfin sodium

HCID 5488036

기본 정보

CAS: 220201-34-3
표준 SMILES: C=Cc1c(C)c2cc3nc(c(CC(=O)N[C@@H](CC(=O)[O-])C(=O)[O-])c4nc(cc5[nH]c(cc1[nH]2)c(C)c5CC)C(C)=C4C(=O)[O-])[C@@H](CCC(=O)[O-])[C@@H]3C.[Na+].[Na+].[Na+].[Na+]
InChIKey: JLWROAPZCOJYGT-OBJGRMLXSA-J
분자식: C38H37N5Na4O9
평균 분자량: 799.7 g/mol
단동위원소 질량: 799.21820488

개요

LS11(talaporfin sodium) is an agent consisting of chlorin e6, derived from chlorophyll, and L-aspartic acid with photosensitizing activity. After intratumoral activation by light emitting diodes, taporfin sodium forms an extended high energy conformational state that generates singlet oxygen, resulting in free radical-mediated cell death. It is used to treat many kinds of cancers.

이름 및 식별자

우선 이름: Talaporfin sodium
IUPAC: tetrasodium;(2S)-2-[[2-[(2S,3S)-7-carboxylato-3-(2-carboxylatoethyl)-17-ethenyl-12-ethyl-2,8,13,18-tetramethyl-2,3,23,24-tetrahydroporphyrin-5-yl]acetyl]amino]butanedioate
영어명: Talaporfin sodium
분자식: C38H42N5NaO9
분자량: 735.77

이름 및 동의어

Talaporfin sodiumLaserphyrin220201-34-3Taporfin sodiumNPe6Talaporfin (sodium salt)LS-11Mono-L-aspartyl chlorin e6Talaporfin sodium [USAN]Talaporfin tetrasodium saltME-2906tetrasodium;(2S)-2-[[2-[(2S,3S)-7-carboxylato-3-(2-carboxylatoethyl)-17-ethenyl-12-ethyl-2,8,13,18-tetramethyl-2,3,23,24-tetrahydroporphyrin-5-yl]acetyl]amino]butanedioate

이름 더 보기

ME2906D01985Talaporfin sodiuM saltTalaporfin sodium (jan/usan)Mono-L-Aspartyl Chlorin e6 Tetrasodium Salt (NPe6)

L63605PZ70ME 2906L-Aspartic acid, N-(((7S,8S)-3-carboxy-7-(2-carboxyethyl)-13-ethenyl-18-ethyl-7,8-dihydro-2,8,12,17-tetramethyl-21H,23H-porphin-5-yl)acetyl)-, tetrasodium saltTetrasodium (2S)-2-((((7S,8S)-3-carboxylato-7-(2-carboxylatoethyl)-13-ethenyl-18-ethyl-2,8,12,17-tetramethyl-7,8-dihydroporphyrin-5-yl)acetyl)amino)butanedioateAptocineTalaporfinsodiumLaserphyrin (TN)Tetrasodium (2S)-2-[[[(7S,8S)-3-carboxylato-7-(2-carboxylatoethyl)-13-ethenyl-18-ethyl-2,8,12,17-tetramethyl-7,8-dihydroporphyrin-5-yl]acetyl]amino]butanedioate

데이터베이스 식별자

CAS: 220201-34-3、220680-62-6
PubChem CID: 5488036
DTXSID: DTXSID70420519
UNII: L63605PZ70

물성

구조 계산 물성

극성 표면적: 247 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 11
회전 가능 결합 수: 8
무거운 원자 수: 56
형식 전하: 0
복잡도: 1,340

물리화학적 성질

저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 2 · DMSO:2.0(Max Conc. mg/mL);2.5(Max Conc. mM)Water:50.0(Max Conc. mg/mL);62.52(Max Conc. mM)
물리적 상태: 고체
색상: Purple to black
SMILES: O=C(C[C@H](NC(C/C1=C2[C@@H](CCC(O[Na])=O)[C@H](C)C(/C=C3N/C(C(C=C)=C\3C)=C\C4=N/C(C(CC)=C4C)=C\C5=C(C(C(O[Na])=O)=C1N5)C)=N\2)=O)C(O[Na])=O)O[Na]

안전 및 규제

안전 데이터

wgk: WGK 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

약리 정보

Mechanism of Action · 1건

Light Sciences Oncology (LSO) aims to en-light-en cancer patients. Light Sciences has developed Light Infusion Therapy (Litx) which is a novel treatment for solid tumors. The therapy involves inserting a flexible light-emitting diode (LED) into a tumor, followed by an injection of LS11 (talaporfin sodium), a light-activated drug. Once the LED activates LS11, molecular oxygen is converted into singlet oxygen, killing tissue within the LED's scope and shutting down the blood supply to the area. The treatment is designed for use on three types of cancers: hepatoma (liver cancer), metastatic colorectal cancer, and Gioma (brain tumor).

응용 분야

용도Talaporfin sodium is photosensitizer for use in photodynamic therapy to destroy tumor tissue.

공급사24 곳

成都健腾生物技术有限公司028-85159085 · [email protected]

武汉布林科技有限公司3456065315 13260619011 · [email protected]

陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]

上海先辉医药科技有限公司13564796979; 13564796979 · [email protected]

上海喀露蓝科技有限公司18149758185 18149758185 · [email protected]

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