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틸루드로닉산,디나트륨염

Tiludronate Disodium

HCID 60936
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
149845-07-8
표준 SMILES
O=P([O-])(O)C(Sc1ccc(Cl)cc1)P(=O)([O-])O.[Na+].[Na+]
InChIKey
SKUHWSDHMJMHIW-UHFFFAOYSA-L
분자식
C7H7ClNa2O6P2S
평균 분자량
362.57 g/mol
단동위원소 질량
361.8922494

개요

Tiludronate Disodium is the disodium salt form of tiludronate, a first-generation, non-nitrogenous bisphosphonate analogue of endogenous pyrophosphate. Tiludronate adsorbs to hydroxyapatite cells, and although the exact mechanism through which this bisphosphonate exerts its effect has yet to be fully elucidated, tiludronate appears to inhibit protein-tyrosine-phosphatase (PTP) in osteoclasts, thereby disrupting the cytoskeletal ring structure and suppressing the bone resorbing activity of osteoclasts. In addition, tiludronate appears to inhibit the vacuolar-type proton ATPase (V-ATPase) in osteoclasts. Altogether, this may reduce the number of osteoclasts, inhibit abnormal bone resorption and reduce bone turnover.

이름 및 식별자

우선 이름
Tiludronate Disodium
IUPAC
disodium;[(4-chlorophenyl)sulfanyl-[hydroxy(oxido)phosphoryl]methyl]-hydroxyphosphinate
현지명
틸루드로닉산,디나트륨염
영어명
Tiludronic acid, disodium salt
분자식
C7H10ClNaO6P2S
분자량
342.6

이름 및 동의어

TILUDRONATE DISODIUM149845-07-8Tiludronic acid disodium saltsr 41319bTiludronate sodiumDTXSID1048621BH6M93CIA0SR-41319BTiludronate disodium anhydrousDTXCID4028547TildrenRefChem:56266
이름 더 보기
틸루드로닉산,디나트륨염SR 41319GUnii-bh6m93cia0Tiludrote disodiumDisodiumTiludronate>Tiludronic acid, disodium saltDisodium (4-chlorophenylthio)methylenediphosphonate(((4-chlorophenyl)thio)methylene)diphosphonic acid, sodium salt
SkelidDisodium TiludronateTILUDRONIC ACID, DISODIUM SALTTiludronate disodium [USAN]Tiludronic Acid (disodium)Disodium dihydrogen (((p-chlorophenyl)thio)methylene)diphosphonatePhosphonic acid, (((4-chlorophenyl)thio)methylene)bis-, disodium saltPhosphonic acid, [[(4-chlorophenyl)thio]methylene]bis-, sodium salt (1:2)

데이터베이스 식별자

CAS
149845-07-8
PubChem CID
60936
DTXSID
DTXSID1048621
ChEMBL
CHEMBL1200448
UNII
BH6M93CIA0
EC Number
682-613-9

물성

구조 계산 물성

극성 표면적
146 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
7
회전 가능 결합 수
4
무거운 원자 수
19
형식 전하
0
복잡도
320

실험 및 물리화학적 성질

Human Drugs · 2건

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Animal DrugsFDA approved animal drugs -> Active ingredient

물리화학적 성질

녹는점
300 °C · >300°C
저장 조건
-20 °C · -20°C Freezer
용해도
메탄올(약간 용해됨), 물(약간 용해됨)
물리적 상태
고체
색상
흰색에서 황백색까지
Merck
14 · 14,9441

화학적 성질

Fine White to Off-White Crystalline Powder

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

독성 정보

Drug Induced Liver Injury · 6건

Drug Induced Liver Injury Rank (DILIrank 2.0)

Tiludronate disodium

vNo-DILI-concern

0

No match

DOI:10.1016/j.drudis.2016.02.015

안전 데이터

HS 번호
2931.39.0030

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationAgents that inhibit BONE RESORPTION and/or favor BONE MINERALIZATION and BONE REGENERATION. They are used to heal BONE FRACTURES and to treat METABOLIC BONE DISEASES such as OSTEOPOROSIS.
응용 분야 · 2건

개요Tiludronate disodium, the first of the third generation of bisphosphonates, was introduced to the market in Switzerland for the treatment of Paget‘s disease. Bisphosphonates have high affinity for bone. When given orally, they are not metabolized but are absorbed, stored, preferentially localized to the skeleton where they inhibit bone resorption and therefore are useful in the treatment of diseases of high bone turnover such as Paget’s disease and hypercalcemia of malignancy. Mechanistically, tiludronate disodium is suggested to be a specific inhibitor of functioning osteoclasts through selective incorporation into the polarized osteoclastlike multinucleated cells and direct interference with the maintenance of the cytoskeletal structure. Tiludronate disodium is reportedly in clinical trials for osteoporosis in post-menopausal women.

용도A biphosphonate bone resorption inhibitor.

상·하류 제품 정보

상류 원료

수산화나트륨염산수소화나트륨Tetraisopropyl methylenediphosphonate

공급사41 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
InvivoChem中国13549236410 · [email protected]
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杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
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深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
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TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
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重庆卡兰医药有限公司[email protected]
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上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
InvivoChem+1-708-310-1919 +1-13798911105 · [email protected]
北京索莱宝科技有限公司17801761073 18101056239 · [email protected]

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