Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
sodium folate 6484-89-5 22986

Structure Other Information
Canonical SMILES C1=CC(=CC=C1C(=O)NC(CCC(=O)[O-])C(=O)[O-])NCC2=CN=C3C(=N2)C(=O)N=C(N3)N.[Na+].[Na+]
Iso SMILES C1=CC(=CC=C1C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-])NCC2=CN=C3C(=N2)C(=O)N=C(N3)N.[Na+].[Na+]
InChI InChI=1S/C19H19N7O6.2Na/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28;;/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30);;/q;2*+1/p-2/t12-;;/m1../s1
InChI Key SWIRFWUEJODNRG-CURYUGHLSA-L
Formula C19H17N7Na2O6
Mol Weight 485.361
XlogP3 0
Charge 0

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Synonyms Information
CAS Name disodium (2R)-2-[[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]-oxomethyl]amino]pentanedioate
IUPAC Name disodium (2R)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
Openeye Name disodium (2R)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
Systematic Name disodium (2R)-2-[[4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioate
Tratitional Name disodium (2R)-2-[[4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioate