Cas no 72963-55-4 (8-Epiiridotrial glucoside)

8-Epiiridotrial glucoside structure
8-Epiiridotrial glucoside structure
Product Name:8-Epiiridotrial glucoside
CAS No:72963-55-4
MF:C16H24O8
MW:344.356966018677
CID:1758469
PubChem ID:155942
Update Time:2024-10-27

8-Epiiridotrial glucoside Chemical and Physical Properties

Names and Identifiers

    • Boschnaloside
    • Cyclopenta(c)pyran-4-carboxaldehyde, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-, (1S,4aS,7R,7aR)-
    • (1S)-1-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-7β-methylcyclopenta[c]pyran-4-carbaldehyde
    • (1S,4aS,7R,7aR)-4-formyl-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl beta-D-glucopyranoside
    • 8-Epiiridotrial glucoside
    • LMPR0102070023
    • (1S,4aS,7R,7aR)-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carbaldehyde
    • C11652
    • Q27105630
    • 4-Formyl-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-yl hexopyranoside
    • Cyclopenta(c)p
    • 72963-55-4
    • NS00093968
    • Cyclopenta(c)pyran-4-carboxaldehyde, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-7-methyl-, (1S-(1alpha,4aalpha,7beta,7aalpha))-
    • DTXSID70993733
    • CHEBI:2320
    • AKOS040763311
    • CHEMBL3622813
    • SCHEMBL9058000
    • Inchi: 1S/C16H24O8/c1-7-2-3-9-8(4-17)6-22-15(11(7)9)24-16-14(21)13(20)12(19)10(5-18)23-16/h4,6-7,9-16,18-21H,2-3,5H2,1H3/t7-,9-,10-,11-,12-,13+,14-,15+,16+/m1/s1
    • InChI Key: MRIFZKMKTDPBHR-XLOWEYQUSA-N
    • SMILES: O([C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)[C@H]1[C@@H]2[C@H](C)CC[C@@H]2C(C=O)=CO1

Computed Properties

  • Exact Mass: 344.14711772 g/mol
  • Monoisotopic Mass: 344.14711772 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 4
  • Complexity: 495
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 9
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 344.36
  • XLogP3: -0.4
  • Topological Polar Surface Area: 126

8-Epiiridotrial glucoside Pricemore >>

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