Icariside I

CAS Registry Number®

56725-99-6
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CAS Name

Icariside I

Molecular Formula

C27H30O11

Molecular Mass

530.52

Cite this Page

Icariside I.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=56725-99-6 (retrieved 2024-09-06) (CAS RN: 56725-99-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    259-260 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C27H30O11/c1-12(2)4-9-15-17(36-27-24(34)22(32)20(30)18(11-28)37-27)10-16(29)19-21(31)23(33)25(38-26(15)19)13-5-7-14(35-3)8-6-13/h4-8,10,18,20,22,24,27-30,32-34H,9,11H2,1-3H3/t18-,20-,22+,24-,27-/m1/s1

InChIKey

InChIKey=IYCPMVXIUPYNHI-WPKKLUCLSA-N

SMILES

C(C=C(C)C)C1=C2C(C(=O)C(O)=C(O2)C3=CC=C(OC)C=C3)=C(O)C=C1O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C(O)=C(OC=2C1=C(O)C=C(OC3OC(CO)C(O)C(O)C3O)C2CC=C(C)C)C=4C=CC(OC)=CC4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-
  • 4H-1-Benzopyran-4-one, 7-(β-D-glucopyranosyloxy)-3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-
  • 7-(β-D-Glucopyranosyloxy)-3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
  • Icarisid I
  • Icariside I

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Deleted or Replaced CAS Registry Numbers

195537-25-8