Identita

Ricinoleate

Neuvedeno · C18H33O3-

01Identita

Lazychem IDLC-100975
CAS RNNeuvedeno
PubChem CID25630959
Molecular formulaC18H33O3-
Molecular weight297.5 g/mol
IUPAC name(Z,12R)-12-hydroxyoctadec-9-enoate
InChIKeyWBHHMMIMDMUBKC-QJWNTBNXSA-M

02Struktura a stereochemie

2D structurePubChem CID 25630959
Two-dimensional chemical structure of Ricinoleate
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure is acyclic, includes aliphatic carbon, has 1 defined stereocentre. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count0
Secondary amines0
Tertiary amines0
SMILESCCCCCC[C@H](C/C=C\CCCCCCCC(=O)[O-])O
InChINeuvedeno

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before 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.

04Stav v Indii

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

05Názvy a vztahy

API a mateřské léčivo

Neuvedeno

Názvy a vztahy

  • ricinoleate
  • (9Z,12R)-12-hydroxyoctadecenoate
  • (9Z,12R)-12-hydroxyoctadec-9-enoate
  • CHEBI:91295
  • RefChem:1098112
  • WBHHMMIMDMUBKC-QJWNTBNXSA-M
  • (12R)-hydroxy-(9Z)-octadecenoate
  • (Z,12R)-12-hydroxyoctadec-9-enoate
  • Q27163197

Nečistoty a související sloučeniny

    06Zdroje