Tapatybė

Phosphopantothenic acid

Nenurodyta · C9H18NO8P

01Tapatybė

Lazychem ID	LC-53545
CAS RN	Nenurodyta
PubChem CID	41635
Molecular formula	C9H18NO8P
Molecular weight	299.21 g/mol
IUPAC name	3-[[(2R)-2-hydroxy-3,3-dimethyl-4-phosphonooxybutanoyl]amino]propanoic acid
InChIKey	XHFVGHPGDLDEQO-ZETCQYMHSA-N

02Struktūra ir stereochemija

Two-dimensional chemical structure of Phosphopantothenic acid — 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 stereocentres	1
Ring count	0
Secondary amines	0
Tertiary amines	0

SMILES	CC(C)(COP(=O)(O)O)[C@H](C(=O)NCCC(=O)O)O
InChI	Nenurodyta

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.