Cas no 126582-70-5 (b-D-Glucopyranoside,4,8-dihydroxy-3-methyl-1-naphthalenyl (9CI))
126582-70-5 structure
Product Name:b-D-Glucopyranoside,4,8-dihydroxy-3-methyl-1-naphthalenyl (9CI)
CAS No:126582-70-5
MF:C17H20O8
MW:352.335906028748
CID:171697
Update Time:2024-03-01
b-D-Glucopyranoside,4,8-dihydroxy-3-methyl-1-naphthalenyl (9CI) Chemical and Physical Properties
Names and Identifiers
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- b-D-Glucopyranoside,4,8-dihydroxy-3-methyl-1-naphthalenyl (9CI)
- Hydropumbagin4-O-glucoside
- Plumbaside A
- β-D-Glucopyranoside, 4,8-dihydroxy-3-methyl-1-naphthalenyl
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- Inchi: 1S/C17H20O8/c1-7-5-10(12-8(13(7)20)3-2-4-9(12)19)24-17-16(23)15(22)14(21)11(6-18)25-17/h2-5,11,14-23H,6H2,1H3
- InChI Key: MRLGZVFLBTWJSX-UHFFFAOYSA-N
- SMILES: CC1C(O)=C2C=CC=C(C2=C(OC2OC(CO)C(O)C(O)C2O)C=1)O
Computed Properties
- Exact Mass: 272.08309
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 25
- XLogP3: -0.254
Experimental Properties
- Density: 1.574±0.06 g/cm3(Predicted)
- Boiling Point: 700.4±60.0 °C(Predicted)
- PSA: 52.54
- pka: 9.23±0.40(Predicted)
b-D-Glucopyranoside,4,8-dihydroxy-3-methyl-1-naphthalenyl (9CI) Related Literature
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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