chempirical

Riboflavin sodium phosphate

C17H20N4NaO9PCAS 130-40-5478.33 g/mol

Open in Covalent MOL file
NHONONNHOHOOHOPO−OOHNa+
AlcoholPhenolPhosphate

Properties

Molecular formula
C17H20N4NaO9P
Molar mass
478.33 g/mol
Exact mass
478.0866 Da
logP
-1.58Crippen estimate
Polar surface area
208.3 Ų
H-bond donors / acceptors
6 / 10
Rotatable bonds
7
Stereocentres
S, S, Rin SMILES atom order

Identifiers

CAS number
130-40-5
SMILES
Cc1cc2nc-3c(O)nc(=O)nc3n(C[C@H](O)[C@H](O)[C@H](O)COP([O-])(=O)O)c2cc1C.[Na+]
InChIKey
WXEASYCOEACRIK-BMZHGHOISA-N
InChI
InChI=1S/C17H21N4O9P.Na/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29;/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29);/t11-,12+,14-;/m0./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

26 names · show all
  • Riboflavin 5′-(dihydrogen phosphate), sodium salt (1:1)
  • Riboflavine 5′-(dihydrogen phosphate), monosodium salt
  • Riboflavin 5′-(dihydrogen phosphate), monosodium salt
  • Riboflavine, 5′-phosphate, sodium salt
  • Benzo[g]pteridine, riboflavin 5′-(dihydrogen phosphate) deriv.
  • Alloxazine mononucleotide sodium salt
  • AMN
  • Coflavinase
  • Cytoflav
  • Flamotide
  • Hyryl
  • Riboflavin 5′-phosphate ester monosodium salt
  • Sodium FMN
  • Riboflavin phosphate sodium
  • Riboflavine-5-phosphate sodium
  • Riboflavine monosodium 5′-phosphate
  • Riboflavine sodium phosphate
  • Riboflavine phosphate sodium
  • Riboflavin-5-phosphoric acid monosodium salt
  • Riboflavin 5′-phosphate sodium
  • Sodium riboflavin-5′-phosphate
  • Sodium riboflavin phosphate
  • Ribo
  • Riboflavin monophosphate monosodium salt
  • Riboflavin 5′-monophosphate sodium salt
  • E 106

Work with Riboflavin sodium phosphate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Riboflavin83-88-566 % similar Flavin adenine dinucleotide sodium salt84366-81-460 % similar Fad146-14-556 % similar Thymidine 5′-(tetrahydrogen triphosphate), sodium salt (1:3)27821-54-138 % similar Sodium glucose 6-phosphate54010-71-837 % similar Fructose 1,6-diphosphate trisodium salt38099-82-036 % similar Trisodium fructose 1,6-diphosphate octahydrate81028-91-335 % similar Uridine-5′-diphosphate disodium salt27821-45-033 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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