In-Silico Structure database (LMISSD)
| |
LM ID | LMGP01019AAL |
---|---|
Common Name | PC(10:0/17:0) |
Systematic Name | 1-decanoyl-2-heptadecanoyl-sn-glycero-3-phosphocholine |
Synonyms | PC(27:0); PC(10:0_17:0) |
Exact Mass | |
Formula | C35H70NO8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphocholines [GP01] |
Sub Class | Diacylglycerophosphocholines [GP0101] |
PubChem Compound ID (CID) | - |
InChIKey | VAWKQTACTKETKO-MGBGTMOVSA-N |
InChI | InChI=1S/C35H70NO8P/c1-6-8-10-12-14-15-16-17-18-19-20-22-24-26-28-35(38)44-33(32 -43-45(39,40)42-30-29-36(3,4)5)31-41-34(37)27-25-23-21-13-11-9-7-2/h33H,6-32H2,1 -5H3/t33-/m1/s1 |
SMILES | [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |