Cas no 151601-87-5 (b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI))

b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI) structure
151601-87-5 structure
Product Name:b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI)
CAS No:151601-87-5
MF:C23H27NO7
MW:429.462987184525
CID:144665
PubChem ID:158546
Update Time:2025-04-19

b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI)
    • (2S,3R,4S,5S,6R)-2-[[(6aR)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • (-)-Asimilobine-2-O-beta-D-glucoside
    • (6aR)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-yl beta-D-glucopyranoside
    • Asimilobine-2-O-glucoside
    • beta-D-Glucopyranoside, 5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo(de,g)quinolin-2-yl, (R)-
    • (2R,3S,4S,5R,6S)-2-(Hydroxymethyl)-6-(((R)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-yl)oxy)tetrahydro-2H-pyran-3,4,5-triol
    • CHEMBL514235
    • (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(9R)-16-methoxy-10-azatetracyclo[7.7.1.0,.0,heptadeca-1(17),2,4,6,13,15-hexaen-15-yl]oxy}oxane-3,4,5-triol
    • (2S,3R,4S,5S,6R)-2-[[(6aR)-1-methoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • DTXSID00164818
    • 151601-87-5
    • Inchi： 1S/C23H27NO7/c1-29-22-15(30-23-21(28)20(27)19(26)16(10-25)31-23)9-12-6-7-24-14-8-11-4-2-3-5-13(11)18(22)17(12)14/h2-5,9,14,16,19-21,23-28H,6-8,10H2,1H3/t14-,16-,19-,20+,21-,23-/m1/s1
    • InChI Key： PPZMUQMLULQLGP-FHBOTZLTSA-N
    • SMILES： O1[C@H](CO)[C@H]([C@@H]([C@H]([C@@H]1OC1=CC2CCN[C@@H]3CC4C=CC=CC=4C(=C1OC)C3=2)O)O)O

Computed Properties

  • Exact Mass: 429.17875220g/mol
  • Monoisotopic Mass: 429.17875220g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 4
  • Complexity: 623
  • 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: 0.8
  • Topological Polar Surface Area: 121?2

b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI) Related Literature

Related Categories

151601-87-5 (b-D-Glucopyranoside,5,6,6a,7-tetrahydro-1-methoxy-4H-dibenzo[de,g]quinolin-2-yl, (R)- (9CI)) Related Products

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