Cas no 815-91-8 (D-altro-2-Heptulose,1,7-bis(dihydrogen phosphate))
815-91-8 structure
Product Name:D-altro-2-Heptulose,1,7-bis(dihydrogen phosphate)
CAS No:815-91-8
MF:C7H16O13P2
MW:370.141665458679
CID:723463
PubChem ID:164735
Update Time:2025-04-19
D-altro-2-Heptulose,1,7-bis(dihydrogen phosphate) Chemical and Physical Properties
Names and Identifiers
-
- D-altro-2-Heptulose,1,7-bis(dihydrogen phosphate)
- sedoheptulose 1,7-bisphosphate
- D-Sedoheptulose 1,7-bisphosphate
- D-altro-Heptulose 1,7-biphosphate
- Altro heptulose 1,7-bisphosphate
- D-altro-hept-2-ulose 1,7-bis(dihydrogen phosphate)
- sedoheptulose-1,7-bisphosphate
- SCHEMBL19025189
- altro-Heptulose 1,7-biphosphate
- C00447
- CHEBI:17969
- [(2R,3R,4R,5S)-2,3,4,5-tetrahydroxy-6-oxo-7-phosphonooxyheptyl] dihydrogen phosphate
- D-altro-2-Heptulose, 1,7-bis(dihydrogen phosphate)
- DTXSID101002018
- (2R,3R,4R,5S)-2,3,4,5-Tetrahydroxy-6-oxoheptane-1,7-diyl bis(dihydrogen phosphate)
- Q27102740
- 815-91-8
- sedoheptulose 1,7-bisphosphate tetraanion
-
- Inchi： 1S/C7H16O13P2/c8-3(1-19-21(13,14)15)5(10)7(12)6(11)4(9)2-20-22(16,17)18/h3,5-8,10-12H,1-2H2,(H2,13,14,15)(H2,16,17,18)/t3-,5-,6-,7-/m1/s1
- InChI Key： OKHXOUGRECCASI-SHUUEZRQSA-N
- SMILES： P(=O)(O)(O)OC[C@H]([C@H]([C@H]([C@@H](C(COP(=O)(O)O)=O)O)O)O)O
Computed Properties
- Exact Mass: 370.007
- Monoisotopic Mass: 370.007
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 13
- Heavy Atom Count: 22
- Rotatable Bond Count: 10
- Complexity: 453
- 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
- XLogP3: -6.1
- Topological Polar Surface Area: 232?2
Experimental Properties
- Density: 2.014
- Boiling Point: 867.3°C at 760 mmHg
- Flash Point: 478.3°C
- Refractive Index: 1.611
- PSA: 251.13000
- LogP: -3.78230
D-altro-2-Heptulose,1,7-bis(dihydrogen phosphate) Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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