D-Sphingosine

• D-Sphingosine
• bmse000850 - data

InCHi String:
InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1

canonical SMILES:
CCCCCCCCCCCCCC=CC(C(CO)N)O
isomeric SMILES:
CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)N)O


PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME
(E,2S,3R)-2-aminooctadec-4-ene-1,3-diol

PUBCHEM iupac CAS NAME
(E,2S,3R)-2-amino-4-octadecene-1,3-diol

PUBCHEM iupac SYSTEMATIC NAME
(E,2S,3R)-2-azanyloctadec-4-ene-1,3-diol



PubChem Substance (SID):   126596890   24899729   24899729
PubChem Compound (CID):   5280335
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   CAS 123-78-4   Beilstein Registry Number 1727294   MDL number MFCD00036751   Sigma-Aldrich S7049_SIGMA   ChEBI CHEBI:16393   BindingDB 50240585   ChEMBL CHEMBL67166