Identità

Digoxin EP mpurity H/ Lanatoside C

CAS 17575-22-3 · C49H76O20

01Identità

Lazychem IDLC-12931
CAS RN17575-22-3
PubChem CID656630
Molecular formulaC49H76O20
Molecular weight985.12 g/mol
IUPAC name(3β,5β,12β)-3-[(O-β-D-Glucopyranosyl-(14)-O-3-O-acetyl-2,6-dideoxy-β-D-ribo-hexopyranosyl-(14)-O-2,6-dideoxy-β-D-ribo-hexopyranosyl-(14)-2,6-dideoxy-β-D-ribo-hexopyranosyl)oxy]-12,14-dihydroxycard-20(22)-enolide
InChIKeyJAYAGJDXJIDEKI-PTGWOZRBSA-N

02Struttura e stereochimica

2D structurePubChem CID 656630
Two-dimensional chemical structure of Digoxin EP mpurity H/ Lanatoside C, CAS 17575-22-3
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 9 rings, includes aliphatic carbon, has 26 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres26
Ring count9
Secondary amines0
Tertiary amines0
SMILESC[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3C[C@H]([C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)OC(=O)C)O
InChINon indicato

03Stereochemistry

The published structure contains 26 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres26Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound2^26Before 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.

04Stato in India

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Nomi e relazioni

API e farmaco progenitore

Digoxin

Impurezze e composti correlati

Nomi e relazioni

  • Digoxin EP mpurity H
  • Lanatoside C
  • Isolanid
  • 17575-22-3
  • Cedilanid
  • Celadigal
  • Isolanide
  • Allocor
  • Cetosanol
  • Lanimerck
  • Lanatosido C
  • Lanatigen C

Impurezze e composti correlati

06Fonti