Molecule:100861: Difference between revisions

InChI	1S/C6H8O6.Na/c7-1-2(8)5-3(9)4(10)6(11)12-5;/h2,5,7-10H,1H2;/q;+1/p-1
InChI-Key	PPASLZSBLFJQEF-UHFFFAOYSA-M
SMILES	O1C(C(CO)O)C([O-])=C(O)C1=O.[Na+]

Properties
CID	23424000
CAS	7317-67-1
IUPAC-Name	sodium;2-[1,2-bis(oxidanyl)ethyl]-4-oxidanyl-5-oxidanylidene-2h-furan-3-olate
Abbreviation	n/a
Trivialname	sodium ascorbate
Exact mass	198.01403222
Molecular formula	C6H7NaO6
LogP	n/a
Has vendors	true
Molecular role	n/a
Synonyms	l-ascorbate sodium,sodium 2-(12-dihydroxyethyl)-4-hydroxy-5-oxo-25-dihydrofuran-3-olate,l-ascorbic acid sodium salt,schembl19378674,ppaslzsblfjqef-uhfffaoysa-m,akos016373592,ft-0627703,ns00078135,en300-297383,23-didehydro-3-o-natrio-d-erythro-hexono-14-lacton

Revision as of 17:49, 23 January 2024

‎

Click here to copy MOL-file.

Click here to show SMILES and InChI.

‎

publication

investigation

@@ Line 1: / Line 1: @@
 {{Molecule
+|trivialname=sodium ascorbate
 |cid=23424000
 |iupacName=sodium;2-[1,2-bis(oxidanyl)ethyl]-4-oxidanyl-5-oxidanylidene-2h-furan-3-olate
 |molecularMass=198.01403222
 |molecularFormula=C<sub>6</sub>H<sub>7</sub>NaO<sub>6</sub>
-|logP=
 |synonyms=l-ascorbate sodium,sodium 2-(12-dihydroxyethyl)-4-hydroxy-5-oxo-25-dihydrofuran-3-olate,l-ascorbic acid sodium salt,schembl19378674,ppaslzsblfjqef-uhfffaoysa-m,akos016373592,ft-0627703,ns00078135,en300-297383,23-didehydro-3-o-natrio-d-erythro-hexono-14-lacton
 |cas=7317-67-1
 |hasVendors=true
-|trivialname=l-ascorbate sodium
-|abbrev=
 |moleculeKey=PPASLZSBLFJQEF-UHFFFAOYSA-M
-|molOrRxn=
+|molOrRxn=-INDIGO-01232417482D
-  -INDIGO-01232417482D
   0  0  0  0  0  0  0  0  0  0 V3000
@@ Line 48: / Line 45: @@
 M  V30 END CTAB
 M  END
 |smiles=O1C(C(CO)O)C([O-])=C(O)C1=O.[Na+]
 |inchi=1S/C6H8O6.Na/c7-1-2(8)5-3(9)4(10)6(11)12-5;/h2,5,7-10H,1H2;/q;+1/p-1
@@ Line 55: / Line 51: @@
 |height=200px
 |float=none
-|parent=
 }}