.DELTA.6-PREDNISOLONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H26O5
Molecular Weight	358.4281
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])C=CC4=CC(=O)C=C[C@]34C

InChI

InChIKey=WFFSJFFZKKRVOE-VWUMJDOOSA-N

InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h3-5,7,9,14-16,18,22,24,26H,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H26O5
Molecular Weight	358.4281
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 `Sat Dec 16 15:24:07 UTC 2023` Edited by `admin` on `Sat Dec 16 15:24:07 UTC 2023`
Record UNII	EEN45FVD9K
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.DELTA.6-PREDNISOLONE

Common Name

English

PREGNA-1,4,6-TRIENE-3,20-DIONE, 11,17,21-TRIHYDROXY-, (11.BETA.)-

Systematic Name

English

PREDNISOLONE IMPURITY H [EP IMPURITY]

Common Name

English

(11.BETA.)-11,17,21-TRIHYDROXYPREGNA-1,4,6-TRIENE-3,20-DIONE

Systematic Name

English

11.BETA.,17,21-TRIHYDROXYPREGNA-1,4,6-TRIENE-3,20-DIONE

Systematic Name

English

NSC-12882

Code

English

6,7-DEHYDROPREDNISOLONE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID90279501