SODIUM FOLINATE

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Synonyms
Status
Molecule Category Salt-form
ATC V03AF06
UNII 4MXU9LJS4Q

Structure

InChI Key FSDMNNPYPVJNAT-RIWFDJIXSA-L
Smiles Nc1nc(O)c2c(n1)NCC(CNc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)N2C=O.[Na+].[Na+]
InChI
InChI=1S/C20H23N7O7.2Na/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;;/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32);;/q;2*+1/p-2/t12?,13-;;/m0../s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H21N7Na2O7
Molecular Weight 517.41
AlogP -0.73
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 7.0
Number of Rotational Bond 10.0
Polar Surface Area 219.84
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 34.0

Cross References

Resources Reference
ChEMBL CHEMBL3707260
FDA SRS 4MXU9LJS4Q
CONTENTS