N-Acetylneuraminic acid; α-Pyranose-form, 8-Me ether; 9-Ac
AlkaPlorer ID: AK283078
Synonym: None
IUPAC Name: 5-acetamido-6-(3-acetyloxy-1-hydroxy-2-methoxypropyl)-2,4-dihydroxyoxane-2-carboxylic acid
Structure
SMILES: COC(COC(C)=O)C(O)C1OC(O)(C(=O)O)CC(O)C1NC(C)=O
InChI: InChI=1S/C14H23NO10/c1-6(16)15-10-8(18)4-14(22,13(20)21)25-12(10)11(19)9(23-3)5-24-7(2)17/h8-12,18-19,22H,4-5H2,1-3H3,(H,15,16)(H,20,21)
InChIKey: PDUISSOECWOIJO-UHFFFAOYSA-N
Reference
CAS: 141364-03-6
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Asterias rubens | Asterias | Asteriidae | Forcipulatida | Asteroidea | Echinodermata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 365.3350000000001
TPSA？: 171.85000000000002
MolLogP？: -2.646899999999996
Number of H-Donors: 5
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|