Hydrocortisone Acetate｜化工社

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HCID 5744作成日：2026年10月27日

Hydrocortisone Acetate

https://huagongshe.com/ja/chemical/5744

Hydrocortisone Acetate の分子構造式

識別子と物理属性

CAS No.	42016-02-4
分子式	C23H32O6
平均分子量	404.5 g/mol
単同位体質量	404.21988874 g/mol
SMILES	CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C
InChIKey	ALEXXDVDDISNDU-JZYPGELDSA-N
PubChem CID	5744
ChEMBL	CHEMBL1091
ChEBI	CHEBI:17609
EC No.	200-004-4
DTXSID	DTXSID20962156

化学・物理的性質

XLogP	2.2
極性表面積	101
水素結合供与体数	2
水素結合受容体数	6
回転可能結合数	4
重原子数	29
形式電荷	0
複雑度	786
Collision Cross Section	207.2 Å² [M+K]+ [CCS Type: DTMethod: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]196.3 Å² [M-H]- [CCS Type: DT198.8 Å² [M+H]+ [CCS Type: DT203 Å² [M+Na]+ [CCS Type: DT196.1 Å² [M+H]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards]196.5 Å² [M-H]-198.7 Å² [M+H]+207 Å² [M+K]+202.9 Å² [M+Na]+

安全性と法規制

GHS 分類	WarningH302 (11.4%): Harmful if swallowed [Warning Acute toxicity, oral]H312 (10.9%): Harmful in contact with skin [Warning Acute toxicity, dermal]H332 (10.9%): Harmful if inhaled [Warning Acute toxicity, inhalation]H361 (92%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]P203, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 175 reports by companies from 20 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
規制情報	Chemical: Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,17-dihydroxy-, (11.beta.)-Status: Active Update: 12-12-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/1992Hydrocortisone acetate: Does not have an individual approval but may be used under an appropriate group standard
その他の安全情報	IMAP assessments - Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,17-dihydroxy-, (11.beta.)-: Environment tier I assessmentIMAP assessments - Pregn-4-ene-3,20-dione, 21-(acetyloxy)-11,17-dihydroxy-, (11.beta.)-: Human health tier I assessment
Hazard Classes and Categories	Acute Tox. 4 (11.4%)Acute Tox. 4 (10.9%)Repr. 2 (92%)
Drug Induced Liver Injury	Drug Induced Liver Injury Rank (DILIrank 2.0)Hydrocortisone acetatevNo-DILI-concernNo matchDOI:10.1016/j.drudis.2016.02.015