Pantothenic acid; (±)-form, Ca salt
AlkaPlorer ID: AK309342
Synonym: None
IUPAC Name: 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate
Structure
SMILES: CC(C)(CO)C(O)C(=O)NCCC(=O)[O-]
InChI: InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/p-1
InChIKey: GHOKWGTUZJEAQD-UHFFFAOYSA-M
Reference
PubChem CID: 5191579
CAS: 79-83-4
LOTUS: LTS0205310
NPASS: NPC328448
COCONUT: CNP0153142.4
Source
Properties Information
Molecule Weight: 218.229
TPSA？: 109.69
MolLogP？: -2.3779999999999983
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | NON-PROTEIN TARGET | Potency | 5.3 | nM | None |
| None | NON-PROTEIN TARGET | Potency | 595.2 | nM | None |