N-Desmethyl N-Acetyl Ulipristal Acetate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H37NO5
Molecular Weight	503.6292
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-Desmethyl N-Acetyl Ulipristal Acetate

Structure Search

SMILES

CN(C(C)=O)C1=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=OPMHQLVARSQUKR-PABOLRIOSA-N

InChI=1S/C31H37NO5/c1-18(33)31(37-20(3)35)15-14-28-26-12-8-22-16-24(36)11-13-25(22)29(26)27(17-30(28,31)4)21-6-9-23(10-7-21)32(5)19(2)34/h6-7,9-10,16,26-28H,8,11-15,17H2,1-5H3/t26-,27+,28-,30-,31-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H37NO5
Molecular Weight	503.6292
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 19:09:33 GMT 2025` Edited by `admin` on `Wed Apr 02 19:09:33 GMT 2025`
Record UNII	TN56M6F85B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Acetamide, N-[4-[(11?)-17-(acetyloxy)-3,20-dioxo-19-norpregna-4,9-dien-11-yl]phenyl]-N-methyl-

Preferred Name

English

N-Desmethyl N-Acetyl Ulipristal Acetate

Common Name

English

[(8S,11R,13S,14S,17R)-17-acetyl-11-[4-[acetyl(methyl)amino]phenyl]-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate

Systematic Name

English

Code System Code Type Description

CAS

244206-56-2

Created by admin on Wed Apr 02 19:09:33 GMT 2025 , Edited by admin on Wed Apr 02 19:09:33 GMT 2025

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PUBCHEM

15908063

Created by admin on Wed Apr 02 19:09:33 GMT 2025 , Edited by admin on Wed Apr 02 19:09:33 GMT 2025

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FDA UNII

TN56M6F85B

Created by admin on Wed Apr 02 19:09:33 GMT 2025 , Edited by admin on Wed Apr 02 19:09:33 GMT 2025

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