N-Desmethyl ulipristal acetate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H35NO4
Molecular Weight	461.5925
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-Desmethyl ulipristal acetate

Structure Search

SMILES

CNC1=CC=C(C=C1)[C@H]2C[C@@]3(C)[C@@H](CC[C@]3(OC(C)=O)C(C)=O)[C@@H]4CCC5=CC(=O)CCC5=C24

InChI

InChIKey=AQCANMLYXHZIRW-GCNJZUOMSA-N

InChI=1S/C29H35NO4/c1-17(31)29(34-18(2)32)14-13-26-24-11-7-20-15-22(33)10-12-23(20)27(24)25(16-28(26,29)3)19-5-8-21(30-4)9-6-19/h5-6,8-9,15,24-26,30H,7,10-14,16H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H35NO4
Molecular Weight	461.5925
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 00:43:13 GMT 2025` Edited by `admin` on `Wed Apr 02 00:43:13 GMT 2025`
Record UNII	5LN8BT223W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3877A

Preferred Name

English

N-Desmethyl ulipristal acetate

Common Name

English

((8S,11R,13S,14S,17R)-17-ACETYL-13-METHYL-11-(4-(METHYLAMINO)PHENYL)-3-OXO-1,2,6,7,8,11,12,14,15,16-DECAHYDROCYCLOPENTA(A)PHENANTHREN-17-YL) ACETATE

Systematic Name

English

ULIPRISTAL ACETATE METABOLITE (3877A)

Common Name

English

N-MONODEMETHYL CDB 2914

Common Name

English

19-NORPREGNA-4,9-DIENE-3,20-DIONE, 17-(ACETYLOXY)-11-(4-(METHYLAMINO)PHENYL)-, (11.BETA.)-

Systematic Name

English

CDB 3877

Common Name

English

(11.BETA.)-17-(ACETYLOXY)-11-(4-(METHYLAMINO)PHENYL)-19-NORPREGNA-4,9-DIENE-3,20-DIONE

Systematic Name

English

MONO- DEMETHYLATED ULIPRISTAL ACETATE

Common Name

English

Code System Code Type Description

CAS

159681-66-0

Created by admin on Wed Apr 02 00:43:13 GMT 2025 , Edited by admin on Wed Apr 02 00:43:13 GMT 2025

PRIMARY

PUBCHEM

15908064

Created by admin on Wed Apr 02 00:43:13 GMT 2025 , Edited by admin on Wed Apr 02 00:43:13 GMT 2025

PRIMARY

FDA UNII

5LN8BT223W

Created by admin on Wed Apr 02 00:43:13 GMT 2025 , Edited by admin on Wed Apr 02 00:43:13 GMT 2025

PRIMARY

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PROGESTERONE RECEPTOR

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Interaction Type:

BINDING

Amount:

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					YF7V70N02B

ULIPRISTAL ACETATE

PARENT -> METABOLITE ACTIVE

Amount:

Name	Property Type	Parameters
Biological Half-life	PHARMACOKINETIC	micronized tablet single dose administration of ulipristal acetate

Tmax	PHARMACOKINETIC	single dose administration of ulipristal acetate micronized tablet