Citrusin A

CAS Registry Number®

105279-09-2

CAS Name

Citrusin A

Molecular Formula

C26H34O12

Molecular Mass

538.54

Cite this Page

Citrusin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=105279-09-2 (retrieved 2024-11-05) (CAS RN: 105279-09-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H34O12/c1-34-18-10-14(4-3-9-27)5-7-16(18)36-20(12-28)22(30)15-6-8-17(19(11-15)35-2)37-26-25(33)24(32)23(31)21(13-29)38-26/h3-8,10-11,20-33H,9,12-13H2,1-2H3/b4-3+/t20-,21-,22-,23-,24+,25-,26-/m1/s1

InChIKey

InChIKey=WHKMPWQXESJAPI-RPSUPKHOSA-N

SMILES

O(C1=C(OC)C=C([C@H]([C@H](OC2=C(OC)C=C(/C=C/CO)C=C2)CO)O)C=C1)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

Canonical SMILES

OCC=CC1=CC=C(OC(CO)C(O)C2=CC=C(OC3OC(CO)C(O)C(O)C3O)C(OC)=C2)C(OC)=C1

Other Names for this Substance

  • β-D-Glucopyranoside, 4-[(1R,2R)-1,3-dihydroxy-2-[4-[(1E)-3-hydroxy-1-propen-1-yl]-2-methoxyphenoxy]propyl]-2-methoxyphenyl
  • β-D-Glucopyranoside, 4-[1,3-dihydroxy-2-[4-(3-hydroxy-1-propenyl)-2-methoxyphenoxy]propyl]-2-methoxyphenyl, [R-(R*,R*)-(E)]-
  • β-D-Glucopyranoside, 4-[(1R,2R)-1,3-dihydroxy-2-[4-[(1E)-3-hydroxy-1-propenyl]-2-methoxyphenoxy]propyl]-2-methoxyphenyl
  • 4-[(1R,2R)-1,3-Dihydroxy-2-[4-[(1E)-3-hydroxy-1-propen-1-yl]-2-methoxyphenoxy]propyl]-2-methoxyphenyl β-D-glucopyranoside
  • Citrusin A