Pentanedioic acid, 3-hydroxy-3-methyl-, mono[2-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-5-hydroxy-6,8-dimethoxy-4-oxo-4H-1-benzopyran-7-yl] ester

CAS Registry Number®

101899-84-7

CAS Name

Pentanedioic acid, 3-hydroxy-3-methyl-, mono[2-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-5-hydroxy-6,8-dimethoxy-4-oxo-4H-1-benzopyran-7-yl] ester

Molecular Formula

C30H34O17

Molecular Mass

666.58

Cite this Page

Pentanedioic acid, 3-hydroxy-3-methyl-, mono[2-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-5-hydroxy-6,8-dimethoxy-4-oxo-4H-1-benzopyran-7-yl] ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=101899-84-7 (retrieved 2024-11-05) (CAS RN: 101899-84-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H34O17/c1-30(40,9-18(33)34)10-19(35)47-28-26(42-3)22(37)20-13(32)8-15(44-25(20)27(28)43-4)12-5-6-14(16(7-12)41-2)45-29-24(39)23(38)21(36)17(11-31)46-29/h5-8,17,21,23-24,29,31,36-40H,9-11H2,1-4H3,(H,33,34)/t17-,21-,23+,24-,29-,30?/m1/s1

InChIKey

InChIKey=FPEYXBLVSDJZDD-HMSOGQHASA-N

SMILES

O(C)C1=C2C(=C(O)C(OC)=C1OC(CC(CC(O)=O)(C)O)=O)C(=O)C=C(O2)C3=CC(OC)=C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C=C3

Canonical SMILES

O=C(O)CC(O)(C)CC(=O)OC1=C(OC)C(O)=C2C(=O)C=C(OC2=C1OC)C=3C=CC(OC4OC(CO)C(O)C(O)C4O)=C(OC)C3

Other Names for this Substance

  • Pentanedioic acid, 3-hydroxy-3-methyl-, mono[2-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-5-hydroxy-6,8-dimethoxy-4-oxo-4H-1-benzopyran-7-yl] ester

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles