(2S,4AS,5AS)-6A-HYDROXY-2-(3-HYDROXYADAMANTAN-1-YL)HEXAHYDROCYCLOPROPA(4,5)PYRROLO(1,2-A)IMIDAZOL-3(2H)-ONE

Details

Stereochemistry	MIXED
Molecular Formula	C17H24N2O3
Molecular Weight	304.3841
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2S,4AS,5AS)-6A-HYDROXY-2-(3-HYDROXYADAMANTAN-1-YL)HEXAHYDROCYCLOPROPA(4,5)PYRROLO(1,2-A)IMIDAZOL-3(2H)-ONE

Structure Search

SMILES

[H][C@@]12C[C@]1([H])N3C(=O)[C@@]([H])(NC3(O)C2)C45CC6CC(CC(O)(C6)C4)C5

InChI

InChIKey=FRYSGXJFJVWGRL-GTFNWJGBSA-N

InChI=1S/C17H24N2O3/c20-14-13(18-17(22)7-11-2-12(11)19(14)17)15-3-9-1-10(4-15)6-16(21,5-9)8-15/h9-13,18,21-22H,1-8H2/t9?,10?,11-,12-,13+,15?,16?,17?/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

(2S,4AS,5AS)-6A-HYDROXY-2-(3-HYDROXYADAMANTAN-1-YL)HEXAHYDROCYCLOPROPA(4,5)PYRROLO(1,2-A)IMIDAZOL-3(2H)-ONE

Systematic Name

English

SAXAGLIPTIN METABOLITE M4

Common Name

English

Code System Code Type Description

FDA UNII

NHA7BVE9GU

Created by admin on Sat Dec 16 18:18:11 GMT 2023 , Edited by admin on Sat Dec 16 18:18:11 GMT 2023

PRIMARY

PUBCHEM

156613756

Created by admin on Sat Dec 16 18:18:11 GMT 2023 , Edited by admin on Sat Dec 16 18:18:11 GMT 2023

PRIMARY

PARENT (METABOLITE)


					8I7IO46IVQ

SAXAGLIPTIN ANHYDROUS

SUBSTANCE RECORD


					NHA7BVE9GU

(2S,4AS,5AS)-6A-HYDROXY-2-(3-HYDROXYADAMANTAN-1-YL)HEXAHYDROCYCLOPROPA(4,5)PYRROLO(1,2-A)IMIDAZOL-3(2H)-ONE