Detail Information

Number qtl-m1016
Declustering Potential(DP) 50
Collision Energy(CE) 30
Observed mass(Da)
Exact mass(Da)
Accurate mass error(ppm)
Molecular formula
Ionization model
Ret. Time(min)
Precursor ions(Q1) 377.2
Product ions(Q3) 243.1
Main fragments 243.1, 145.1, 216.0, 172.3
Compound Vitamin B2
Identification putative
class Vitamin
Organism
Reference Taheri P et. al (2010)
CV(%)
H2
ChEBI_ID CHEBI:17015
Agricola Citation Links
ArrayExpress Database Links
BRAND Names
Beilstein Registry Numbers 97831;;
BioModels Database Links BIOMD0000000497;;BIOMD0000000496;;BIOMD0000000470;;BIOMD0000000469;;
CAS Registry Numbers 83-88-5;;
COMe Database Links
ChEBI ID
ChEBI Name riboflavin;;
Charge 0;;
Chinese Abstracts Citation Links
CiteXplore Citation Links
Definition D-Ribitol in which the hydroxy group at position 5 is substituted by a 7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl moiety. It is a nutritional factor found in milk, eggs, malted barley, liver, kidney, heart, and leafy veg
DrugBank Database Links DB00140;;
Formulae C17H20N4O6;;
Gmelin Registry Numbers
INN riboflavinum;;riboflavine;;riboflavina;;riboflavin;;
IUPAC Names 5-deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol;;
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;;
InChIKey AUNGANRZJHBGPY-SCRDCRAPSA-N;;
IntAct Database Links
IntEnz Database Links
KEGG COMPOUND Database Links
KEGG DRUG Database Links D00050
KEGG GLYCAN Database Links
LIPID MAPS class Database Links
LIPID MAPS instance Database Links
Last Modified 25 Feb 2016;;
Mass 376.36390;;
MolBase Database Links
PDBeChem Database Links
Patent Database Links WO2007133981;;WO2007131286;;WO2007130886;;WO2007130777;;WO2007130119;;WO2007127172;;WO2007121479;;WO2007106457;;WO2007103528;;WO2006094248;;WO2006094237;;WO2006094236;;WO2006094235;;WO2005067644;;WO2005014594;;WO2005010160;;US2876169;;US2807611;;US2007269
PubChem Database Links 8144638;;
PubMed Central Citation Links
PubMed Citation Links 9808225;;9184778;;8976642;;8678471;;8604671;;8487103;;7883462;;7101408;;6650303;;6546833;;6475825;;4019261;;3878498;;3592624;;3142982;;2631092;;2369885;;22770225;;19212411;;182198;;16658098;;14963913;;12354259;;11606856;;10566553;;
RESID Database Links
Reactome Database Links R-HSA-3165230;;R-HSA-196964;;R-HSA-196950;;
Rhea Database Links
SABIO-RK Database Links 964;;7291;;653;;277;;1843;;12838;;
SMILES Cc1cc2nc3c(nc(=O)[nH]c3=O)n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C;;
Secondary ChEBI ID CHEBI:529204;;CHEBI:8843;;CHEBI:27299;;CHEBI:15044;;CHEBI:45214;;
Star 3;;
Synonyms vitamin G;;vitamin B2;;Vitasan B2;;Vitaflavine;;San Yellow B;;Russupteridine yellow III;;Ribovel;;Ribotone;;Ribosyn;;Riboflavine;;Riboderm;;Ribocrisina;;Ribipca;;Lactoflavine;;Lactobene;;Hyre;;Food Yellow 15;;Flaxain;;Flavin BB;;Flavaxin;;E101;;E 101;;Ben
UM-BBD compID Database Links
UniProt Database Links Q9ZNM0;;Q9ZN56;;Q9ZL42;;Q9ZL40;;Q9Z820;;Q9Z735;;Q9Z734;;Q9Z733;;Q9YDC5;;Q9YC88;;Q9YA27;;Q9Y7P0;;Q9XH32;;Q9X2I1;;Q9X2E6;;Q9X2E5;;Q9X1Z1;;Q9X1G6;;Q9WY65;;Q9UYX4;;Q9UVT8;;Q9UUB1;;Q9STY4;;Q9RXZ8;;Q9RPU2;;Q9REF4;;Q9PLJ6;;Q9PLJ5;;Q9PLJ4;;Q9PJZ1;;Q9PIB9;;Q9PHU4;
ChEBI Image