GLYCINE, N,N-DIETHYL-, (2-BETA,5-ALPHA,17-ALPHA)-2-ETHYNYL-17-HYDROXY-A-NORPREGN-20-YN-2-YL ESTER

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H41NO3
Molecular Weight	439.63
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of GLYCINE, N,N-DIETHYL-, (2-BETA,5-ALPHA,17-ALPHA)-2-ETHYNYL-17-HYDROXY-A-NORPREGN-20-YN-2-YL ESTER

Structure Search

SMILES

[H][C@]12C[C@](C[C@]1(C)[C@@]3([H])CC[C@@]4(C)[C@@]([H])(CC[C@@]4(O)C#C)[C@]3([H])CC2)(OC(=O)CN(CC)CC)C#C

InChI

InChIKey=HHVPLNURXZZGOP-VUXVUIOGSA-N

InChI=1S/C28H41NO3/c1-7-27(32-24(30)18-29(9-3)10-4)17-20-11-12-21-22(25(20,5)19-27)13-15-26(6)23(21)14-16-28(26,31)8-2/h1-2,20-23,31H,9-19H2,3-6H3/t20-,21+,22-,23-,25-,26-,27+,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H41NO3
Molecular Weight	439.63
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 08:54:02 GMT 2023` Edited by `admin` on `Sat Dec 16 08:54:02 GMT 2023`
Record UNII	5R3U56ZU74
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GLYCINE, N,N-DIETHYL-, (2-BETA,5-ALPHA,17-ALPHA)-2-ETHYNYL-17-HYDROXY-A-NORPREGN-20-YN-2-YL ESTER

Common Name

English

[(2R,3aS,3bS)-2,6-diethynyl-6-hydroxy-3a,5a-dimethyl-1,3,3b,4,5,7,8,8a,8b,9,10,10a-dodecahydroindeno[5,4-e]inden-2-yl]2-(diethylamino)acetate

Systematic Name

English

Glycine, N,N-diethyl-, (2R,3aS,3bS,6R,8aS,8bR,10aS)-2,6-diethynylhexadecahydro-6-hydroxy-3a,5a-dimethyldicyclopenta[a,f]naphthalen-2-yl ester

Common Name

English

Code System Code Type Description

FDA UNII

5R3U56ZU74

Created by admin on Sat Dec 16 08:54:02 GMT 2023 , Edited by admin on Sat Dec 16 08:54:02 GMT 2023

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PUBCHEM

3072451

Created by admin on Sat Dec 16 08:54:02 GMT 2023 , Edited by admin on Sat Dec 16 08:54:02 GMT 2023

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CAS

142546-51-8

Created by admin on Sat Dec 16 08:54:02 GMT 2023 , Edited by admin on Sat Dec 16 08:54:02 GMT 2023

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EPA CompTox

DTXSID90931516

Created by admin on Sat Dec 16 08:54:02 GMT 2023 , Edited by admin on Sat Dec 16 08:54:02 GMT 2023

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