β-D-Glucopyranoside, 2-hydroxy-4-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]phenyl, 6-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]

CAS Registry Number®

871018-29-0

CAS Name

β-D-Glucopyranoside, 2-hydroxy-4-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]phenyl, 6-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]

Molecular Formula

C30H30O14

Molecular Mass

614.55

Cite this Page

β-D-Glucopyranoside, 2-hydroxy-4-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]phenyl, 6-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=871018-29-0 (retrieved 2024-12-24) (CAS RN: 871018-29-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    122.4-124.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H30O14/c1-40-23-12-17(5-7-19(23)32)29(39)42-13-16-3-8-22(21(34)11-16)43-30-28(38)27(37)26(36)24(44-30)14-41-25(35)9-4-15-2-6-18(31)20(33)10-15/h2-12,24,26-28,30-34,36-38H,13-14H2,1H3/b9-4+/t24-,26-,27+,28-,30-/m1/s1

InChIKey

InChIKey=IMVLKRZWKQBCNJ-ZAHDVKFQSA-N

SMILES

O([C@@H]1O[C@H](COC(/C=C/C2=CC(O)=C(O)C=C2)=O)[C@@H](O)[C@H](O)[C@H]1O)C3=C(O)C=C(COC(=O)C4=CC(OC)=C(O)C=C4)C=C3

Canonical SMILES

O=C(OCC1OC(OC2=CC=C(C=C2O)COC(=O)C3=CC=C(O)C(OC)=C3)C(O)C(O)C1O)C=CC4=CC=C(O)C(O)=C4

Other Names for this Substance

  • β-D-Glucopyranoside, 2-hydroxy-4-[[(4-hydroxy-3-methoxybenzoyl)oxy]methyl]phenyl, 6-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]
  • Litseaefoloside C

CAS INSIGHTSTM
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