Cas no 93060-87-8 (1D-Myo-inositol 4,5-bisphosphate)
93060-87-8 structure
Product Name:1D-Myo-inositol 4,5-bisphosphate
CAS No:93060-87-8
MF:C6H14O12P2
MW:340.115684986115
CID:804910
PubChem ID:125004
Update Time:2024-10-26
1D-Myo-inositol 4,5-bisphosphate Chemical and Physical Properties
Names and Identifiers
-
- myo-Inositol,4,5-bis(dihydrogen phosphate) (9CI)
- inositol 4,5-bisphosphate
- 1D-myo-inositol 4,5-bisphosphate
- 4,5,-IP2
- d-myo-inositol-4,5-bisphosphate
- 1D-myo-inositol 4,5-bis(dihydrogen phosphate)
- IP2
- Inositol 4,5-biphosphate
- Inositol-4,5-bisphosphate
- myo-Inositol 4,5-diphosphate
- Ins(4,5)P2
- myo-Inositol 4,5-bisphosphate
- GTPL5119
- D-myo-Inositol 4,5-bisphosphate
- BDBM50284584
- myo-Inositol, 4,5-bis(dihydrogen phosphate)
- C04064
- A19369
- 8-methyl-8-aza-bicyclo[3.2.1]octan-3-ami
- (1R,2R,3S,4R,5S,6S)-3,4,5,6-tetrahydroxycyclohexane-1,2-diyl bis[dihydrogen (phosphate)]
- {[(1R,2S,3R,4S,5S,6R)-2,3,4,5-tetrahydroxy-6-(phosphonooxy)cyclohexyl]oxy}phosphonic acid
- CHEBI:18156
- 93060-87-8
- CHEMBL21825
- Q27073747
- [(1R,2S,3S,4R,5S,6R)-2,3,4,5-tetrahydroxy-6-phosphonooxycyclohexyl] dihydrogen phosphate
- PD048560
- SCHEMBL9387601
- 1D-Myo-inositol 4,5-bisphosphate
-
- Inchi： 1S/C6H14O12P2/c7-1-2(8)4(10)6(18-20(14,15)16)5(3(1)9)17-19(11,12)13/h1-10H,(H2,11,12,13)(H2,14,15,16)/t1-,2+,3-,4-,5+,6+/m0/s1
- InChI Key： MCKAJXMRULSUKI-UZAAGFTCSA-N
- SMILES： P(=O)(O)(O)O[C@@H]1[C@H]([C@H]([C@H]([C@@H]([C@H]1OP(=O)(O)O)O)O)O)O
Computed Properties
- Exact Mass: 339.99604987g/mol
- Monoisotopic Mass: 339.99604987g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 12
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 388
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 6
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 214
- XLogP3: -5.9
1D-Myo-inositol 4,5-bisphosphate Related Literature
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
93060-87-8 (1D-Myo-inositol 4,5-bisphosphate) Related Products
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