Cas no 523-94-4 (1,3-di-O-methylmyoinositol)
1,3-di-O-methylmyoinositol structure
Product Name:1,3-di-O-methylmyoinositol
CAS No:523-94-4
MF:C8H16O6
MW:208.209043502808
CID:2034548
PubChem ID:21627888
Update Time:2025-04-21
1,3-di-O-methylmyoinositol Chemical and Physical Properties
Names and Identifiers
-
- 1,3-di-O-methylmyoinositol
- 1.3-Di-O-methyl-myo-inosit
- 1r.3c-Dimethoxy-cyclohexantetrol-(2c.4t.5c.6t)
- Dambonit
- dambonitol
- Dambonitol, 1,3-Di-O-Methylinosit
- Dambonite
- CHEBI:173588
- DTXSID601318426
- SCHEMBL12858900
- SCHEMBL4087933
- 523-94-4
- (1R,3S,4R,6S)-4,6-dimethoxycyclohexane-1,2,3,5-tetrol
-
- Inchi： 1S/C8H16O6/c1-13-7-4(10)3(9)5(11)8(14-2)6(7)12/h3-12H,1-2H3/t3?,4-,5+,6?,7+,8-
- InChI Key： MMCIFJWGSIWJLP-XAMPRYAMSA-N
- SMILES： O(C)[C@H]1[C@@H](C([C@@H]([C@H](C1O)OC)O)O)O
Computed Properties
- Exact Mass: 208.095
- Monoisotopic Mass: 208.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 169
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 99.4A^2
- XLogP3: -2.6
1,3-di-O-methylmyoinositol Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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