Cas no 10196-10-8 (6-o-Phosphonohexopyranosyl hexopyranoside)
10196-10-8 structure
Product Name:6-o-Phosphonohexopyranosyl hexopyranoside
CAS No:10196-10-8
MF:C12H23O14P
MW:422.276386499405
CID:6644283
PubChem ID:1144
Update Time:2024-03-02
6-o-Phosphonohexopyranosyl hexopyranoside Chemical and Physical Properties
Names and Identifiers
-
- DTXSID90274298
- CHEBI:182126
- CERAPP_31410
- 237A69AA-28B7-43B7-97CA-8FA15EA23C56
- [3,4,5-trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate
- 10196-10-8
- SCHEMBL3671592
- [3,4,5-Trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-oxan-2-yl]methoxyphosphonic acid
- DTXSID10863406
- 6-o-phosphonohexopyranosyl hexopyranoside
- 6-o-Phosphonohexopyranosyl hexopyranoside
-
- Inchi： 1S/C12H23O14P/c13-1-3-5(14)7(16)9(18)11(24-3)26-12-10(19)8(17)6(15)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)
- InChI Key： LABSPYBHMPDTEL-UHFFFAOYSA-N
- SMILES： P(=O)(O)(O)OCC1C(C(C(C(O1)OC1C(C(C(C(CO)O1)O)O)O)O)O)O
Computed Properties
- Exact Mass: 422.08254240g/mol
- Monoisotopic Mass: 422.08254240g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 9
- Hydrogen Bond Acceptor Count: 14
- Heavy Atom Count: 27
- Rotatable Bond Count: 6
- Complexity: 528
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 10
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -5.8
- Topological Polar Surface Area: 236?2
6-o-Phosphonohexopyranosyl hexopyranoside Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
10196-10-8 (6-o-Phosphonohexopyranosyl hexopyranoside) Related Products
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