N-((TRANS-4-((1S)-2-HYDROXY-1-METHYLETHYL)CYCLOHEXYL)CARBONYL)-D-PHENYLALANINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H27NO4
Molecular Weight	333.4227
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-((TRANS-4-((1S)-2-HYDROXY-1-METHYLETHYL)CYCLOHEXYL)CARBONYL)-D-PHENYLALANINE

Structure Search

SMILES

C[C@]([H])(CO)[C@]1([H])CC[C@]([H])(CC1)C(=N[C@]([H])(Cc2ccccc2)C(=O)O)O

InChI

InChIKey=GMHTWYIGIMINLF-MWQQHZPXSA-N

InChI=1S/C19H27NO4/c1-13(12-21)15-7-9-16(10-8-15)18(22)20-17(19(23)24)11-14-5-3-2-4-6-14/h2-6,13,15-17,21H,7-12H2,1H3,(H,20,22)(H,23,24)/t13-,15-,16-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H27NO4
Molecular Weight	333.4227
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Jun 26 12:39:15 UTC 2021` Edited by `admin` on `Sat Jun 26 12:39:15 UTC 2021`
Record UNII	N364WXG0U3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-((TRANS-4-((1S)-2-HYDROXY-1-METHYLETHYL)CYCLOHEXYL)CARBONYL)-D-PHENYLALANINE

Systematic Name

English

D-PHENYLALANINE, N-((TRANS-4-((1S)-2-HYDROXY-1-METHYLETHYL)CYCLOHEXYL)CARBONYL)-

Systematic Name

English

NATEGLINIDE (METABOLITE M2,M3), (S)-

Common Name

English

NATEGLINIDE (M2,M3), (S)-

Common Name

English

Code System Code Type Description

PUBCHEM

91667683

Created by admin on Sat Jun 26 12:39:15 UTC 2021 , Edited by admin on Sat Jun 26 12:39:15 UTC 2021

PRIMARY

FDA UNII

N364WXG0U3

Created by admin on Sat Jun 26 12:39:15 UTC 2021 , Edited by admin on Sat Jun 26 12:39:15 UTC 2021

PRIMARY

CAS

183996-83-0

Created by admin on Sat Jun 26 12:39:15 UTC 2021 , Edited by admin on Sat Jun 26 12:39:15 UTC 2021

PRIMARY

Related Record Type Details


					41X3PWK4O2

NATEGLINIDE

PARENT -> METABOLITE