Cas no 13345-95-4 (1,5-Dihydroriboflavin)
1,5-Dihydroriboflavin structure
Product Name:1,5-Dihydroriboflavin
CAS No:13345-95-4
MF:C17H22N4O6
MW:378.379784107208
CID:2736056
Update Time:2023-08-07
1,5-Dihydroriboflavin Chemical and Physical Properties
Names and Identifiers
-
- 1,5-dihydro-riboflavin
- 1,5-dihydroriboflavin
- reduced riboflavin
- Leukoflavin
- C01007
- Q27102473
- 1,5-Dihydroriboflavin
-
- Inchi： 1S/C17H22N4O6/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/h3-4,11-12,14,18,22-25H,5-6H2,1-2H3,(H2,19,20,26,27)/t11-,12+,14-/m0/s1
- InChI Key： SGSVWAYHEWEQET-SCRDCRAPSA-N
- SMILES： O[C@H]([C@@H]([C@@H](CO)O)O)CN1C2=C(C(NC(N2)=O)=O)NC2C=C(C)C(C)=CC1=2
Computed Properties
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 27
- Rotatable Bond Count: 5
- Complexity: 641
- XLogP3: -1.2
- Topological Polar Surface Area: 154
1,5-Dihydroriboflavin Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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