Идентичност

Ononitol, (+)-

Не е посочено · C7H14O6

01Идентичност

Lazychem IDLC-113339
CAS RNНе е посочено
PubChem CID164619
Molecular formulaC7H14O6
Molecular weight194.18 g/mol
IUPAC name(1S,2S,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
InChIKeyDSCFFEYYQKSRSV-FEPQRWDDSA-N

02Структура и стереохимия

2D structurePubChem CID 164619
Two-dimensional chemical structure of Ononitol, (+)-
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 1 ring, includes aliphatic carbon, has 4 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres4
Ring count1
Secondary amines0
Tertiary amines0
SMILESCOC1[C@@H]([C@H](C([C@@H]([C@@H]1O)O)O)O)O
InChIНе е посочено

03Stereochemistry

The published structure contains 4 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres4Structure assigned
Unassigned centres2Structure unspecified
Assignment statusPartially assignedExact published identity
Tetrahedral upper bound≤ 64Before symmetry reduction

Published same-connectivity configurations

3 records

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.

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.

04Статус в Индия

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

05Имена и връзки

API и изходно лекарство

Не е посочено

Имена и връзки

    Примеси и сродни съединения

      06Източници