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L-Erythro-Sphingosine

CAT: 0013-GTR19200319-01Size: 500 µgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200319-01Size:500 µg
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Description
Erythro-sphingosine, (+) -
CAS Number
6036-75-5
Smiles
C (=C/CCCCCCCCCCCCC) \[C@@H] ([C@@H] (CO) N) O
Molecular Formula
C18H37NO2
Molecular Weight
299.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

L-erythro-Sphingosine

L-erythro-sphingosine is a (2R,3S)-2-aminooctadec-4-ene-1,3-diol in which the double bond has E geochemistry. It is a conjugate base of a L-erythro-sphingosine(1+). It is an enantiomer of a sphingosine.

CAS Number6036-75-5
PubChem CID5496506
IUPAC Name(E,2R,3S)-2-aminooctadec-4-ene-1,3-diol
Molecular FormulaC18H37NO2
Molecular Weight299.5
XLogP5.3
Topological Polar Surface Area66.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Heavy Atom Count21
Formal Charge0
Complexity231
SMILES
CCCCCCCCCCCCC/C=C/[C@@H]([C@@H](CO)N)O
InChI
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+/m1/s1
InChIKey
WWUZIQQURGPMPG-MCXRAWCPSA-N
Chemical Structure
2D Structure
2D structure of L-erythro-Sphingosine
CAS: 6036-75-5
CID: 5496506
Formula: C18H37NO2
MW: 299.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight299.5
XLogP35.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Exact Mass299.282429423
Monoisotopic Mass299.282429423
Topological Polar Surface Area66.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity231
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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