Cas no 122991-48-4 (1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol)
![1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol structure](https://ossimg.kuujia.com/scimg/123000/122991-48-4x500.png)
122991-48-4 structure
Product Name:1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol
CAS No:122991-48-4
MF:C41H78O12S
MW:795.115833759308
CID:6643955
PubChem ID:481096
Update Time:2024-03-02
1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol Chemical and Physical Properties
Names and Identifiers
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- 1,2-Di-O-palmitoyl-3-O-(6-sulfoquinovopyranosyl)glycerol
- [6-[2,3-di(hexadecanoyloxy)propoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid
- CHEBI:143042
- 122991-48-4
- SQDG 16:0_16:0
- CHEMBL1207915
- 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL
- [6-((2S)-2,3-Dihexadecanoyloxypropoxy)(2S,3S,4S,6S,5R)-3,4,5-trihydroxy-2H-3,4,5,6-tetrahydropyran-2-yl]methanesulfonic acid
- Q27465454
- (2S)-2,3-Bis[(1-oxohexadecyl)oxy]propyl 6-deoxy-6-sulfo-alpha-D-glucopyranoside
- DTXSID901142608
- [(2S,3S,4S,5R,6S)-6-[(2S)-2,3-di(hexadecanoyloxy)propoxy]-3,4,5-trihydroxy-tetrahydropyran-2-yl]methanesulfonic acid
- 1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol
-
- Inchi： 1S/C41H78O12S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(42)50-31-34(32-51-41-40(46)39(45)38(44)35(53-41)33-54(47,48)49)52-37(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h34-35,38-41,44-46H,3-33H2,1-2H3,(H,47,48,49)
- InChI Key： RVUUQPKXGDTQPG-UHFFFAOYSA-N
- SMILES： S(CC1C(C(C(C(OCC(COC(CCCCCCCCCCCCCCC)=O)OC(CCCCCCCCCCCCCCC)=O)O1)O)O)O)(=O)(=O)O
Computed Properties
- Exact Mass: 794.52139909g/mol
- Monoisotopic Mass: 794.52139909g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 12
- Heavy Atom Count: 54
- Rotatable Bond Count: 38
- Complexity: 1020
- 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
- XLogP3: 11.5
- Topological Polar Surface Area: 195?2
1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol Related Literature
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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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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
122991-48-4 (1,2-DI-O-Acyl-3-O-[6-deoxy-6-sulfo-alpha-D-glucopyranosyl]-SN-glycerol) Related Products
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