Prednisone acetate

HCID 91438CAS 125-10-0

기본 정보

표준 SMILES
CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@@]21C
InChIKey
MOVRKLZUVNCBIP-RFZYENFJSA-N
분자식
C23H28O6
평균 분자량
400.5 g/mol
단동위원소 질량
400.18858862

개요

Cortancyl is a tertiary alpha-hydroxy ketone, a 17alpha-hydroxy steroid, a 20-oxo steroid, an acetate ester, an 11-oxo steroid, a steroid ester and a 3-oxo-Delta(1),Delta(4)-steroid. It is functionally related to a prednisone.

이름 및 식별자

우선 이름
Prednisone acetate
IUPAC
[2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
영어명
Prednisone 21-acetate
분자식
C23H28O6
분자량
400.46

이름 및 동의어

Prednisone acetatePrednisone 21-acetate125-10-0Cortancyldelta1-Cortisone-21-acetatedelta'-Dehydrocortisone acetateprednisone-21-acetateOU93QEL83U21-Acetoxy-17alpha-hydroxypregna-1,4-diene-3,11,20-trioneNSC-109651,4-Pregnadien-17alpha,21-diol-3,11,20-trione-21-acetateCHEBI:34655
이름 더 보기
Prendnisone acetateFerrCblconind-CorlindeltalonePrednisone 21-acetat
DTXSID20154539RefChem:868422DTXCID3077030204-726-0DelcortinNisonedelta-corlinPregna-1,4-diene-3,11,20-trione, 21-(acetyloxy)-17-hydroxy-

데이터베이스 식별자

CAS
125-10-0
PubChem CID
91438
DTXSID
DTXSID20154539
ChEMBL
CHEMBL1507567
ChEBI
CHEBI:34655
UNII
OU93QEL83U
EC Number
204-726-0
Nikkaji
J86.135I

물성

구조 계산 물성

XLogP
1.5
극성 표면적
97.7 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
29

실험 및 물리화학적 성질

Endocrine DisruptorsPotential endocrine disrupting compound

물리화학적 성질

녹는점
240 · 240-242°C (dec.)
끓는 점
582 · 582.0±50.0 °C(Predicted)
밀도
1.28 · 1.28±0.1 g/cm3(Predicted)
저장 조건
Refrigerator
용해도
클로로포름 (약간 용해됨), 디옥산 (난용성), DMSO (약간 용해됨), 메탄올 (약간 용해됨)
물리적 상태
고체

화학적 성질

White Solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (16.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P304+P340, P305+P351+P338, P318, P319, P330, P337+P317, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 14-01-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/22156
Other Safety InformationIMAP assessments - Pregna-1,4-diene-3,11,20-trione, 21-(acetyloxy)-17-hydroxy-: Environment tier I assessment
Hazard Classes and CategoriesEye Irrit. 2 (16.7%)

안전 데이터

신호 어
Warning
유해·위험 문구
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H361

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 3건

Substances that reduce or suppress INFLAMMATION.

A group of CORTICOSTEROIDS that affect carbohydrate metabolism (GLUCONEOGENESIS, liver glycogen deposition, elevation of BLOOD SUGAR), inhibit ADRENOCORTICOTROPIC HORMONE secretion, and possess pronounced anti-inflammatory activity. They also play a role in fat and protein metabolism, maintenance of arterial blood pressure, alteration of the connective tissue response to injury, reduction in the number of circulating lymphocytes, and functioning of the central nervous system.

Antineoplastic agents that are used to treat hormone-sensitive tumors. Hormone-sensitive tumors may be hormone-dependent, hormone-responsive, or both. A hormone-dependent tumor regresses on removal of the hormonal stimulus, by surgery or pharmacological block. Hormone-responsive tumors may regress when pharmacologic amounts of hormones are administered regardless of whether previous signs of hormone sensitivity were observed. The major hormone-responsive cancers include carcinomas of the breast, prostate, and endometrium; lymphomas; and certain leukemias. (From AMA Drug Evaluations Annual 1994, p2079)

응용 분야

용도Adrenocortical steroid antiinflammatory.

공급사50 곳

成都埃法生物科技有限公司028-028-85142057 19983342022 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
Hong Kong Tiansheng New Material Trading Co., Ltd+8617320695765 · [email protected]
湖北金梭生物科技有限公司00123456789 · [email protected]
Hebei shuoxi biotechnology co. LTD+8613081092107

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