In-Silico Structure database (LMISSD)
| |
LM ID | LMGP10019AAN |
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Common Name | PA(10:0/17:2(9Z,12Z)) |
Systematic Name | 1-decanoyl-2-(9Z,12Z-heptadecadienoyl)-sn-glycero-3-phosphate |
Synonyms | PA(27:2); PA(10:0_17:2) |
Exact Mass | |
Formula | C30H55O8P |
Category | Glycerophospholipids [GP] |
Main Class | Glycerophosphates [GP10] |
Sub Class | Diacylglycerophosphates [GP1001] |
PubChem Compound ID (CID) | - |
InChIKey | YVQWUEIIFHTTCC-SMTUVBDUSA-N |
InChI | InChI=1S/C30H55O8P/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-25-30(32)38-28(27-37 -39(33,34)35)26-36-29(31)24-22-20-18-10-8-6-4-2/h9,11,13-14,28H,3-8,10,12,15-27H 2,1-2H3,(H2,33,34,35)/b11-9-,14-13-/t28-/m1/s1 |
SMILES | [C@](COP(=O)(O)O)([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCCC)=O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |