Riboflavin

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Systematic / IUPAC Name: 7,8-Dimethyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione

ID: Reference590

Other Names: 6,7-Dimethyl-9-D-ribitylisoalloxazine;
7,8-Dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)isoalloxazine;
1-Deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol;
7,8-Dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione;
D-Ribitol, 1-deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo(g)pteridin-10(2H)-yl)- ; more

Formula: C17H20N4O6

Class: Endogenous Metabolites

Spectral Data

Riboflavin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 272
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI
Analyzers FT
Last Modification 2/10/2015 1:29:44 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m0/s1
InChI Key AUNGANRZJHBGPY-SCRDCRAPSA-N
Canonical SMILES CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O
CAS 83885
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Other Names 6,7-Dimethyl-9-D-ribitylisoalloxazine;
7,8-Dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)isoalloxazine;
1-Deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol;
7,8-Dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione;
D-Ribitol, 1-deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo(g)pteridin-10(2H)-yl)-;
Isoalloxazine, 7,8-dimethyl-10-D-ribityl-;
5-Deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol;
Pentitol, 1-deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-;
Vitamin B2;
Lactoflavin;
Vitamin G;
Lactoflavine;
Beflavin;
Flavaxin;
Riboflavine;
Ribocrisina;
Vitaflavine;
Beflavine;
Flaxain;
Lactobene;
Ribipca;
Riboderm;
Ribosyn;
Ribotone;
Ribovel;
Flavin BB;
Vitasan B2;
Hyre;
Fiboflavin;
Dermadram;
Hyflavin;
Aqua-flave;
Riboflavinequinone;
Ovoflavin

In Other Databases

PubChem 493570
Wikipedia Riboflavin
ChEBI CHEBI:17015
ChEMBL CHEMBL1534
HMDb HMDB00244
ChemSpider 431981
KEGG D00050; C00255