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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H9NO6
Molecular Weight 191.1388
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOSORBIDE 2-NITRATE

SMILES

[H][C@]12OC[C@H](O[N+]([O-])=O)[C@@]1([H])OC[C@H]2O

InChI

InChIKey=YWXYYJSYQOXTPL-JGWLITMVSA-N
InChI=1S/C6H9NO6/c8-3-1-11-6-4(13-7(9)10)2-12-5(3)6/h3-6,8H,1-2H2/t3-,4+,5-,6-/m1/s1

HIDE SMILES / InChI

Molecular Formula C6H9NO6
Molecular Weight 191.1388
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:59:07 UTC 2023
Edited
by admin
on Sat Dec 16 07:59:07 UTC 2023
Record UNII
21BMF8FI0K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOSORBIDE 2-NITRATE
Common Name English
ISOSORBIDE DINITRATE, DILUTED IMPURITY B [EP IMPURITY]
Common Name English
ISOSORBIDE 2-MONONITRATE
Common Name English
1,4:3,6-DIANHYDRO-D-GLUCITOL 2-NITRATE
Common Name English
ISOSORBIDE MONONITRATE, DILUTED IMPURITY C [EP IMPURITY]
Common Name English
D-GLUCITOL, 1,4:3,6-DIANHYDRO-, 2-NITRATE
Systematic Name English
DILUTED ISOSORBIDE MONONITRATE RELATED COMPOUND A [USP-RS]
Common Name English
ISOSORBIDE NITRATE
Common Name English
ISOSORBIDE MONONITRATE RELATED COMPOUND A [USP IMPURITY]
Common Name English
ISOSORBIDE-2-MONONITRATE
Common Name English
Code System Code Type Description
EVMPD
SUB35553
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
SMS_ID
100000128484
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
RS_ITEM_NUM
1353113
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
CAS
16106-20-0
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
PUBCHEM
62989
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
ECHA (EC/EINECS)
240-271-4
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
FDA UNII
21BMF8FI0K
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
EPA CompTox
DTXSID40873331
Created by admin on Sat Dec 16 07:59:07 UTC 2023 , Edited by admin on Sat Dec 16 07:59:07 UTC 2023
PRIMARY
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