ELETRIPTAN HEMISULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C22H26N2O2S.H2O4S
Molecular Weight	863.117
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(O)(=O)=O.CN1CCC[C@@H]1CC2=CNC3=C2C=C(CCS(=O)(=O)C4=CC=CC=C4)C=C3.CN5CCC[C@@H]5CC6=CNC7=C6C=C(CCS(=O)(=O)C8=CC=CC=C8)C=C7

InChI

InChIKey=IYVZCNNIKYUHHM-WXMGBDCWSA-N

InChI=1S/2C22H26N2O2S.H2O4S/c2*1-24-12-5-6-19(24)15-18-16-23-22-10-9-17(14-21(18)22)11-13-27(25,26)20-7-3-2-4-8-20;1-5(2,3)4/h2*2-4,7-10,14,16,19,23H,5-6,11-13,15H2,1H3;(H2,1,2,3,4)/t2*19-;/m11./s1

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C22H26N2O2S
Molecular Weight	382.519
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:24:33 UTC 2023` Edited by `admin` on `Fri Dec 15 16:24:33 UTC 2023`
Record UNII	AMM8PSU28B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ELETRIPTAN HEMISULFATE

Common Name

English

Code System Code Type Description

PUBCHEM

9832589

Created by admin on Fri Dec 15 16:24:33 UTC 2023 , Edited by admin on Fri Dec 15 16:24:33 UTC 2023

PRIMARY

CAS

219790-71-3

Created by admin on Fri Dec 15 16:24:33 UTC 2023 , Edited by admin on Fri Dec 15 16:24:33 UTC 2023

PRIMARY

FDA UNII

AMM8PSU28B

Created by admin on Fri Dec 15 16:24:33 UTC 2023 , Edited by admin on Fri Dec 15 16:24:33 UTC 2023

PRIMARY

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