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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C17H19NO3.H2O4S
Molecular Weight 668.754
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MORPHINE SULFATE ANHYDROUS

SMILES

OS(O)(=O)=O.[H][C@@]12OC3=C4C(C[C@@]5([H])N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3O.[H][C@@]67OC8=C9C(C[C@@]%10([H])N(C)CC[C@@]69[C@@]%10([H])C=C[C@@H]7O)=CC=C8O

InChI

InChIKey=USAHOPJHPJHUNS-IFCNUISUSA-N
InChI=1S/2C17H19NO3.H2O4S/c2*1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;1-5(2,3)4/h2*2-5,10-11,13,16,19-20H,6-8H2,1H3;(H2,1,2,3,4)/t2*10-,11+,13-,16-,17-;/m00./s1

HIDE SMILES / InChI

Molecular Formula C17H19NO3
Molecular Weight 285.3377
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:07:33 UTC 2023
Edited
by admin
on Fri Dec 15 16:07:33 UTC 2023
Record UNII
DY70C97N30
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MORPHINE SULFATE ANHYDROUS
Common Name English
MORPHINAN-3,6-DIOL, 7,8-DIDEHYDRO-4,5-EPOXY-17-METHYL, (5.ALPHA.,6.ALPHA.)-, SULFATE (2:1) (SALT)
Common Name English
Morphine sulfate [WHO-DD]
Common Name English
7,8-DIDEHYDRO-4,5.ALPHA.-EPOXY-17-METHYLMORPHINAN-3,6.ALPHA.-DIOL SULFATE (2:1) (SALT)
Common Name English
MORPHINE SULFATE ANHYDROUS [MI]
Common Name English
MORPHINE SULPHATE ANHYDROUS
Common Name English
MORPHINE SULFATE,ANHYDROUS
Common Name English
NSC-11441
Code English
MORPHINAN-3,6-DIOL, 7,8-DIDEHYDRO-4,5-EPOXY-17-METHYL, (5.ALPHA.,6.ALPHA.)-, SULPHATE (2:1) (SALT)
Common Name English
7,8-DIDEHYDRO-4,5.ALPHA.-EPOXY-17-METHYLMORPHINAN-3,6.ALPHA.-DIOL SULPHATE (2:1) (SALT)
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 600603
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
NCI_THESAURUS C67413
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID4023830
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
NSC
11441
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
FDA UNII
DY70C97N30
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
NCI_THESAURUS
C91049
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
PUBCHEM
5462349
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
MERCK INDEX
m7631
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
ECHA (EC/EINECS)
200-582-8
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
SMS_ID
100000076239
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
CAS
64-31-3
Created by admin on Fri Dec 15 16:07:33 UTC 2023 , Edited by admin on Fri Dec 15 16:07:33 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
PARENT -> SALT/SOLVATE
SUBSTANCE->BASIS OF STRENGTH
Related Record Type Details
ACTIVE MOIETY