Tunnistetiedot

Citramalic acid, (-)-

Ei ilmoitettu · C5H8O5

01Tunnistetiedot

Lazychem IDLC-107743
CAS RNEi ilmoitettu
PubChem CID439766
Molecular formulaC5H8O5
Molecular weight148.11 g/mol
IUPAC name(2R)-2-hydroxy-2-methylbutanedioic acid
InChIKeyXFTRTWQBIOMVPK-RXMQYKEDSA-N

02Rakenne ja stereokemia

2D structurePubChem CID 439766
Two-dimensional chemical structure of Citramalic acid, (-)-
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.
SMILESC[C@@](CC(=O)O)(C(=O)O)O
InChIEi ilmoitettu

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.

04Tila Intiassa

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

05Nimet ja suhteet

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      06Lähteet