CHEBI:32098 - riboflavin sodium phosphate

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ChEBI Name riboflavin sodium phosphate
ChEBI ID CHEBI:32098
Stars This entity has been manually annotated by a third party.
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Formulae C17H20N4NaO9P
C17H20N4NaO9P.2H2O
Net Charge 0
Average Mass 478.326
Monoisotopic Mass 478.08656
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);/q;+1/p-1/t11-,12+,14-;/m0./s1
InChIKey OHSHFZJLPYLRIP-BMZHGHOISA-M
SMILES C12=C(C=C(C(=C1)C)C)N(C=3C(=N2)C(NC(N3)=O)=O)C[C@@H]([C@H](O)[C@H](O)COP(O)([O-])=O)O.[Na+]
ChEBI Ontology
Outgoing riboflavin sodium phosphate (CHEBI:32098) has functional parent riboflavin (CHEBI:17015)
riboflavin sodium phosphate (CHEBI:32098) is a ribitol phosphate (CHEBI:26554)
Synonym Source
Riboflavin sodium phosphate KEGG COMPOUND
Manual Xref Database
D01622 KEGG DRUG
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Registry Number Type Source
130-40-5 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017