D-ERYTHRO-SPHINGOSINE-1-PHOSPHATE

The Sphingosine 1-phosphate, with the CAS registry number 26993-30-6, is also known as (4E)-2-Amino-3-hydroxy-4-octadecen-1-yl dihydrogen phosphate. It belongs to the product categories of Chemical Activators; Activators; Fatty Acid Derivatives & Lipids; Glycerols; Inhibitors; Protein Kinase Inhibitors and Activators; Angiogenic Factors Sphingolipids; Angiogenesis; Cancer Research; Lipids in Cell Signaling; Sphingoid bases; Sphingolipids. This chemical's molecular formula is C₁₈H₃₈NO₅P and molecular weight is 379.47. What's more, its IUPAC name is [(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enyl] dihydrogen phosphate. It should be protected from strong oxidizers. What's more, its storage temperature is -20°C.

Physical properties of Sphingosine 1-phosphate are: (1)ACD/LogP: 5.46; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 2.69; (4)ACD/LogD (pH 7.4): 1.99; (5)ACD/BCF (pH 5.5): 14.12; (6)ACD/BCF (pH 7.4): 2.82; (7)ACD/KOC (pH 5.5): 37.86; (8)ACD/KOC (pH 7.4): 7.57; (9)#H bond acceptors: 6; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 19; (12)Polar Surface Area: 67.04 Å²; (13)Index of Refraction: 1.501; (14)Molar Refractivity: 102.17 cm³; (15)Molar Volume: 346.7 cm³; (16)Surface Tension: 45.6 dyne/cm; (17)Density: 1.094 g/cm³; (18)Flash Point: 285.7 °C; (19)Enthalpy of Vaporization: 95.23 kJ/mol; (20)Boiling Point: 548.8 °C at 760 mmHg; (21)Vapour Pressure: 2.49E-14 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCCCC=CC(C(COP(=O)(O)O)N)O
(2)Isomeric SMILES: CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)(O)O)N)O
(3)InChI: InChI=1S/C18H38NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(20)17(19)16-24-25(21,22)23/h14-15,17-18,20H,2-13,16,19H2,1H3,(H2,21,22,23)/b15-14+/t17-,18+/m0/s1
(4)InChIKey: DUYSYHSSBDVJSM-KRWOKUGFSA-N