Chemical identity

Diosmin-7-O-beta-D-Glucoside

CAS 20126-59-4 · C22H22O11

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-13121
PubChem CID11016019
NameDiosmin-7-O-beta-D-Glucoside
CAS RN20126-59-4
Molecular formulaC22H22O11
Molecular weight462.41 g/mol
IUPAC name5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
InChIKeyWKUHPOMCLBLCOV-MIUGBVLSSA-N

02Structure identifiers

2D structurePubChem CID 11016019
2D structure: Diosmin-7-O-beta-D-Glucoside, CAS 20126-59-4
Structure of Diosmin-7-O-beta-D-Glucoside (CAS 20126-59-4). LazyChem record. Source identity: PubChem CID 11016019. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC22H22O11
InChIKeyWKUHPOMCLBLCOV-MIUGBVLSSA-N
Ring count4
Defined stereocentres5
Unassigned stereocentres0
SMILESCOC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O
InChIInChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1

03Stereochemistry

The published structure contains 5 defined and 0 unassigned tetrahedral stereocentres. The exact wedge-and-dash depiction is shown above.

Defined stereocentres52D structure
Unassigned stereocentres02D structure
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 32Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 20126-59-4 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 20126-59-4 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Diosmin

View API and impurity family

Other names

  • Diosmetin 7-O-beta-D-glucoside
  • Diosmetol 7-glucoside
  • Diosmetin 7-O-glucoside
  • Eridictiol
  • Flavone, 3',5,7-trihydroxy-4'-methoxy-, 7-beta-D-glucopyranoside
  • diosmetin-7-o-beta-d-glucopyranoside
  • Diosmetin-7-O-

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources