In-Silico Structure database (LMISSD)
| |
LM ID | LMGP03019AAN |
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Common Name | PS(10:0/17:2(9Z,12Z)) |
Systematic Name | 1-decanoyl-2-(9Z,12Z-heptadecadienoyl)-sn-glycero-3-phosphoserine |
Synonyms | PS(27:2); PS(10:0_17:2) |
Exact Mass | |
Formula | C33H60NO10P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphoserines [GP03] |
Sub Class | Diacylglycerophosphoserines [GP0301] |
PubChem Compound ID (CID) | - |
InChIKey | KQPWDOIZDBRSMI-YEOORWTGSA-N |
InChI | InChI=1S/C33H60NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-25-32(36)44-29(27- 42-45(39,40)43-28-30(34)33(37)38)26-41-31(35)24-22-20-18-10-8-6-4-2/h9,11,13-14, 29-30H,3-8,10,12,15-28,34H2,1-2H3,(H,37,38)(H,39,40)/b11-9-,14-13-/t29-,30+/m1/s 1 |
SMILES | C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCCC) =O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |