Swertiamarin

CAS Registry Number®

17388-39-5
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CAS Name

Swertiamarin

Molecular Formula

C16H22O10

Molecular Mass

374.34

Cite this Page

Swertiamarin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17388-39-5 (retrieved 2024-05-05) (CAS RN: 17388-39-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    112-114 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1

InChIKey

InChIKey=HEYZWPRKKUGDCR-QBXMEVCASA-N

SMILES

C(=C)[C@@H]1[C@@]2(O)C(=CO[C@H]1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)OCC2

Canonical SMILES

O=C1OCCC2(O)C1=COC(OC3OC(CO)C(O)C(O)C3O)C2C=C

Other Names for this Substance

  • 1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-4a-hydroxy-, (4aR,5R,6S)-
  • Swertiamarin
  • 1H,3H-Pyrano[3,4-c]pyran-1-one, 5-ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-4a-hydroxy-, [4aR-(4aα,5β,6α)]-
  • (4aR,5R,6S)-5-Ethenyl-6-(β-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-4a-hydroxy-1H,3H-pyrano[3,4-c]pyran-1-one
  • Swertiamarine

View All

Deleted or Replaced CAS Registry Numbers

28633-33-2

CAS INSIGHTSTM
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