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Details

Stereochemistry EPIMERIC
Molecular Formula C17H23NO4
Molecular Weight 305.3688
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-HYDROXYHYOSCYAMINE

SMILES

CN1[C@H]2CC(O)[C@@H]1C[C@@H](C2)OC(=O)[C@H](CO)C3=CC=CC=C3

InChI

InChIKey=WTQYWNWRJNXDEG-YFVFXCHESA-N
InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12-,13-,14-,15+,16?/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H23NO4
Molecular Weight 305.3688
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:27:06 UTC 2023
Edited
by admin
on Sat Dec 16 05:27:06 UTC 2023
Record UNII
IK9LA7J3XW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-HYDROXYHYOSCYAMINE
Common Name English
ATROPINE SULFATE IMPURITY E [EP IMPURITY]
Common Name English
BENZENEACETIC ACID, .ALPHA.-(HYDROXYMETHYL)-, (1S,3R,5S)-6-HYDROXY-8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL ESTER, (.ALPHA.S)-
Common Name English
(1S,3R,5S,6RS)-6-HYDROXY-8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL (2S)-3-HYDROXY-2-PHENYLPROPANOATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50241683
Created by admin on Sat Dec 16 05:27:06 UTC 2023 , Edited by admin on Sat Dec 16 05:27:06 UTC 2023
PRIMARY
PUBCHEM
71587892
Created by admin on Sat Dec 16 05:27:06 UTC 2023 , Edited by admin on Sat Dec 16 05:27:06 UTC 2023
PRIMARY
CAS
949092-65-3
Created by admin on Sat Dec 16 05:27:06 UTC 2023 , Edited by admin on Sat Dec 16 05:27:06 UTC 2023
PRIMARY
FDA UNII
IK9LA7J3XW
Created by admin on Sat Dec 16 05:27:06 UTC 2023 , Edited by admin on Sat Dec 16 05:27:06 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
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PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP