STRYCHNINE SULFATE PENTAHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C21H22N2O2.5H2O.H2O4S
Molecular Weight	856.978
Optical Activity	UNSPECIFIED
Defined Stereocenters	12 / 12
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of STRYCHNINE SULFATE PENTAHYDRATE

Structure Search

SMILES

O.O.O.O.O.OS(O)(=O)=O.[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C7=C(C=CC=C7)[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H].[H][C@]89C[C@@]%10([H])C%11=CCO[C@@]%12([H])CC(=O)N%13C%14=C(C=CC=C%14)[C@@]8(CCN9C%11)[C@]%13([H])[C@@]%10%12[H]

InChI

InChIKey=FDQUTDUZMOOVST-ZKOSLKCXSA-N

InChI=1S/2C21H22N2O2.H2O4S.5H2O/c2*24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21;1-5(2,3)4;;;;;/h2*1-5,13,16-17,19-20H,6-11H2;(H2,1,2,3,4);5*1H2/t2*13-,16-,17-,19-,20-,21+;;;;;;/m00....../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	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C21H22N2O2
Molecular Weight	334.4116
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:29:33 UTC 2023` Edited by `admin` on `Fri Dec 15 17:29:33 UTC 2023`
Record UNII	3D8109DYZ8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

STRYCHNINE SULFATE PENTAHYDRATE

Common Name

English

STRYCHNINE SULPHATE, PENTAHYDRATE

Common Name

English

STRYCHNIDIN-10-ONE, SULFATE (2:1), PENTAHYDRATE

Common Name

English

STRYCHNINE SULFATE, PENTAHYDRATE

Common Name

English

STRYCHNINUM SULPHURICUM [HPUS]

Common Name

English

STRYCHNIDIN-10-ONE, SULPHATE (2:1), PENTAHYDRATE

Common Name

English

STRYCHNINUM SULPHURICUM

Common Name

English

Code System Code Type Description

SMS_ID

300000029182