PREDNAZATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H32O8.C21H26ClN3OS
Molecular Weight	864.485
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OCCN1CCN(CCCN2C3=CC=CC=C3SC4=C2C=C(Cl)C=C4)CC1.[H][C@@]56CC[C@](O)(C(=O)COC(=O)CCC(O)=O)[C@@]5(C)C[C@H](O)[C@@]7([H])[C@@]6([H])CCC8=CC(=O)C=C[C@]78C

InChI

InChIKey=QKKLKGVIECOSRM-CODXZCKSSA-N

InChI=1S/C25H32O8.C21H26ClN3OS/c1-23-9-7-15(26)11-14(23)3-4-16-17-8-10-25(32,24(17,2)12-18(27)22(16)23)19(28)13-33-21(31)6-5-20(29)30;22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h7,9,11,16-18,22,27,32H,3-6,8,10,12-13H2,1-2H3,(H,29,30);1-2,4-7,16,26H,3,8-15H2/t16-,17-,18-,22+,23-,24-,25-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C21H26ClN3OS
Molecular Weight	403.969
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C25H32O8
Molecular Weight	460.5168
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:15:05 UTC 2023` Edited by `admin` on `Fri Dec 15 16:15:05 UTC 2023`
Record UNII	71099P640P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PREDNAZATE

Official Name

English

11β,17,21-Trihydroxypregna-1,4-diene-3,20-dione, 21-(hydrogen succinate), compound with 4-[3-(2-chlorophenothiazin-10-yl)propyl]-1-piperazineethanol (1:1)

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 21-(3-CARBOXY-1-OXOPROPOXY)-11,17-DIHYDROXY-, (11.BETA.)-, COMPD. WITH 4-(3-(2-CHLORO-10H-PHENOTHIAZIN-10-YL)PROPYL)-1-PIPERAZINEETHANOL (1:1)

Common Name

English

66-20

Code

English

PREDNISOLONE 21-HEMISUCCINATE PERPHENAZINE (1:1)

Common Name

English

prednazate [INN]

Common Name

English

SCH-6620

Code

English

PREDNAZATE [USAN]

Common Name

English

SCH 6620

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C2356