clavaminol I
AlkaPlorer ID: AK096178
Synonym: None
IUPAC Name: [(2R,3S)-2-acetamidododecan-3-yl] acetate
Structure
SMILES: CCCCCCCCC[C@H](OC(C)=O)[C@@H](C)N=C(C)O
InChI: InChI=1S/C16H31NO3/c1-5-6-7-8-9-10-11-12-16(20-15(4)19)13(2)17-14(3)18/h13,16H,5-12H2,1-4H3,(H,17,18)/t13-,16+/m1/s1
InChIKey: TUQIUNWHHVJPHY-CJNGLKHVSA-N
Reference
Clavaminols G–N, six new marine sphingoids from the Mediterranean ascidian Clavelina phlegraea
PubChem CID: 101464716
LOTUS: LTS0110724
SuperNatural Ⅲ: SN0360471-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clavelina oblonga | Clavelina | Clavelinidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 285.428
TPSA？: 58.89
MolLogP？: 4.423700000000004
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|