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Sodium folate

HCID 136359212
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
6484-89-5
Standard SMILES
Nc1nc2ncc(CNc3ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)O)cc3)nc2c(=O)[nH]1.[Na+]
InChIKey
ZTYOEHTVHXWFJT-YDALLXLXSA-M
Molecular formula
C19H18N7NaO6
Average molar mass
463.4 g/mol
Monoisotopic mass
463.1216256

Names & identifiers

Preferred name
Sodium folate
IUPAC
sodium (4S)-4-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoate

Names & synonyms

Sodium folateFolate (sodium)6484-89-5SCHEMBL31409452ZTYOEHTVHXWFJT-YDALLXLXSA-M

Database identifiers

CAS
6484-89-5
PubChem CID
136359212
EC Number
229-348-3

Properties

Computed structural propertiesFilling in

Topological polar surface area
212 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
10
Rotatable bonds
9
Heavy atoms
33
Formal charge
0
Complexity
774

Related reactions

2 records
New reaction record
HRID 1156490 reaction equation
HRID 1156490As reactantuspto-grants-1982_06
HRID 1681705 reaction equation
HRID 1681705As reactantuspto-grants-1992_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes