Cas no 132586-69-7 (Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]-)

Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]- structure
132586-69-7 structure
Product Name:Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]-
CAS No:132586-69-7
MF:C20H24O12
MW:456.397367477417
CID:837041
PubChem ID:44593505
Update Time:2025-04-19

Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]- Chemical and Physical Properties

Names and Identifiers

    • Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]-
    • 15-Demethylplumieride
    • (1S,4aS,7R,7aS)-1-(β-D-Glucopyranosyloxy)-4'-[(1S)-1-hydroxyethyl ]-5'-oxo-4a,7a-dihydro-1H,5'H-spiro[cyclopenta[c]pyran-7,2'-furan ]-4-carboxylic acid
    • Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,...
    • Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-
    • (4aS,7aS)-tert-butyl 6-benzyloctahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
    • 1-BOC-6-BENZYLOCTAHYDROPYRROLO[3,4-B]PYRIDINE
    • 6-benzyl-1-t-butoxycarbonyloctahydropyrrolo[3.4-b]pyridine
    • AC1Q1N4I
    • AG-C-19061
    • CTK7G3153
    • PubChem18885
    • SureCN2381394
    • tert-butyl 6-benzyloctahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate
    • Agoniadin; NSC 609065
    • BDBM50480283
    • 132586-69-7
    • (1S,4aS,7R,7aS)-4'-[(1S)-1-hydroxyethyl]-5'-oxo-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[4a,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-furan]-4-carboxylic acid
    • Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1,4a,7(R*),7a]]-
    • AKOS032948826
    • FS-10304
    • CHEMBL464702
    • Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-4a,7a-dihydro-4'-[(1S)-1-hydroxyethyl]-5'-oxo-, (1S,2'R,4aS,7aS)-
    • (1S,4aS,7R,7aS)-4'-((1S)-1-hydroxyethyl)-5'-oxo-1-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxyspiro(4a,7a-dihydro-1H-cyclopenta(c)pyran-7,2'-furan)-4-carboxylic acid
    • Inchi: 1S/C20H24O12/c1-7(22)9-4-20(32-17(9)28)3-2-8-10(16(26)27)6-29-18(12(8)20)31-19-15(25)14(24)13(23)11(5-21)30-19/h2-4,6-8,11-15,18-19,21-25H,5H2,1H3,(H,26,27)/t7-,8+,11+,12+,13+,14-,15+,18-,19-,20+/m0/s1
    • InChI Key: GGLAWDIODKKBQZ-SZSWQRSVSA-N
    • SMILES: O1C(C([C@H](C)O)=C[C@]21C=C[C@@H]1C(C(=O)O)=CO[C@H]([C@H]21)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)=O

Computed Properties

  • Exact Mass: 456.12700
  • Monoisotopic Mass: 456.12677620g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 5
  • Complexity: 880
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.5
  • Topological Polar Surface Area: 192?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 815.5±65.0 °C at 760 mmHg
  • Flash Point: 287.9±27.8 °C
  • PSA: 192.44000
  • LogP: -2.46730
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]- Security Information

Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]- Pricemore >>

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Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]- Production Method

Spiro[cyclopenta[c]pyran-7(1H),2'(5'H)-furan]-4-carboxylic acid, 1-(b-D-glucopyranosyloxy)-4a,7a-dihydro-4'-(1-hydroxyethyl)-5'-oxo-, [1S-[1a,4aa,7a(R*),7aa]]- Related Literature

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