Chem
J-GLOBAL ID:200907033057680860
Nikkaji number:J601.107A
3-Isobutylriboflavin
3-イソブチルリボフラビン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C21 H28 N4 O6
Molecular formula furigana:
C21-H28-N4-O6
Molecular weight:
432.477
InChI:
InChI=1S/C21H28N4O6/c1-10(2)7-25-20(30)17-19(23-21(25)31)24(8-15(27)18(29)16(28)9-26)14-6-12(4)11(3)5-13(14)22-17/h5-6,10,15-16,18,26-29H,7-9H2,1-4H3/t15-,16+,18-/m0/s1
InChI key:
VVULQTKXODAGSQ-JZXOWHBKSA-N
SMILES:
CC(C)Cn1c(=O)nc2n(C[C@H](O)[C@H](O)[C@H](O)CO)c3cc(C)c(C)cc3nc2c1=O
Systematic name (3):
3-イソブチルリボフラビン
7,8-ジメチル-3-(2-メチルプロピル)-10-[(2S,3S,4R)-2,3,4,5-テトラヒドロキシペンチル]-2H,3H,4H,10H-ベンゾ[g]プテリジン-2,4-ジオン
7,8-dimethyl-3-(2-methylpropyl)-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione
Other name (1):
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