21-DEHYDRO-6.ALPHA.-METHYL PREDNISOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28O5
Molecular Weight	372.4547
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 21-DEHYDRO-6.ALPHA.-METHYL PREDNISOLONE

Structure Search

SMILES

[H][C@@]12CC[C@](O)(C(=O)C=O)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])C[C@H](C)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=QZZDSEJBNWOIRY-PJHHCJLFSA-N

InChI=1S/C22H28O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,11-12,14-15,17,19,25,27H,5,7-8,10H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H28O5
Molecular Weight	372.4547
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:02:39 GMT 2023` Edited by `admin` on `Sat Dec 16 19:02:39 GMT 2023`
Record UNII	2GSF7W6RRG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

21-DEHYDRO-6.ALPHA.-METHYL PREDNISOLONE

Common Name

English

METHYLPREDNISOLONE ACETATE IMPURITY C [EP IMPURITY]

Common Name

English

2-((6S,8S,9S,10R,11S,13S,14S,17R)-11,17-DIHYDROXY-6,10,13-TRIMETHYL-3-OXO-7,8,9,11,12,14,15,16-OCTAHYDRO-6H-CYCLOPENTA(A)PHENANTHREN-17-YL)-2-OXOACETALDEHYDE

Systematic Name

English

PREGNA-1,4-DIEN-21-AL, 11.BETA.,17-DIHYDROXY-6.ALPHA.-METHYL-3,20-DIOXO-

Systematic Name

English

11.BETA.,17-DIHYDROXY-6.ALPHA.-METHYLPREGNA-1,4-DIENE-3,20,21-TRIONE

Systematic Name

English

PREGNA-1,4-DIEN-21-AL, 11,17-DIHYDROXY-6-METHYL-3,20-DIOXO-, (6.ALPHA.,11.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

88818823

Created by admin on Sat Dec 16 19:02:39 GMT 2023 , Edited by admin on Sat Dec 16 19:02:39 GMT 2023

PRIMARY

CAS

58636-50-3

Created by admin on Sat Dec 16 19:02:39 GMT 2023 , Edited by admin on Sat Dec 16 19:02:39 GMT 2023

PRIMARY

FDA UNII

2GSF7W6RRG

Created by admin on Sat Dec 16 19:02:39 GMT 2023 , Edited by admin on Sat Dec 16 19:02:39 GMT 2023

PRIMARY

Related Record Type Details


					43502P7F0P

METHYLPREDNISOLONE ACETATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: