1,2-Distearoyl phosphatidyl serine
PubChem CID: 44147587
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 1,2-Distearoyl phosphatidyl serine, CHEBI:192272, (2R)-2-amino-3-[[(2R)-2-butanoyloxy-3-propanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid |
|---|---|
| Topological Polar Surface Area | 172.0 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 25.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 497.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (2R)-2-amino-3-[[(2R)-2-butanoyloxy-3-propanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid |
| Prediction Hob | 0.0 |
| Xlogp | -3.5 |
| Molecular Formula | C13H24NO10P |
| Prediction Swissadme | 0.0 |
| Inchi Key | UNJJBGNPUUVVFQ-NXEZZACHSA-N |
| Fcsp3 | 0.7692307692307693 |
| Logs | -5.624 |
| Rotatable Bond Count | 15.0 |
| Logd | 5.47 |
| Compound Name | 1,2-Distearoyl phosphatidyl serine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 385.114 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 385.114 |
| Hydrogen Bond Acceptor Count | 11.0 |
| Molecular Weight | 385.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 0.9409027999999997 |
| Inchi | InChI=1S/C13H24NO10P/c1-3-5-12(16)24-9(6-21-11(15)4-2)7-22-25(19,20)23-8-10(14)13(17)18/h9-10H,3-8,14H2,1-2H3,(H,17,18)(H,19,20)/t9-,10-/m1/s1 |
| Smiles | CCCC(=O)O[C@H](COC(=O)CC)COP(=O)(O)OC[C@H](C(=O)O)N |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Onobrychis Viciifolia (Plant) Rel Props:Source_db:cmaup_ingredients