| SpectraBase Spectrum ID |
JOJbtXAaZxt |
| Name |
BMP 10:0_19:0 |
| Classification |
Glycerophospholipids [GP] |
| Comments |
Bismonoacylglycerophosphate |
| Copyright |
Copyright © 2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
680.462835410 u |
| Formula |
C35H69O10P |
| InChI |
InChI=1S/C35H69O10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-27-35(39)45-33(29-37)31-43-46(40,41)42-30-32(28-36)44-34(38)26-24-22-20-10-8-6-4-2/h32-33,36-37H,3-31H2,1-2H3,(H,40,41) |
| InChIKey |
IKDLPGKVIJHPQQ-UHFFFAOYNA-N |
| Ion Polarity |
P |
| Literature Reference |
Tsugawa, H.; Ikeda, K.; Takahashi, M.; Satoh, A.; Mori, Y.; Uchino, H.; Okahashi, N.; Yamada, Y.; Tada, I.; Bonini, P.; Higashi, Y.; Okazaki, Y.; Zhou, Z.; Zhu, Z.-J.; Koelmel, J.; Cajka, T.; Fiehn, O.; Saito, K.; Arita, M.; Arita, M. A Lipidome Atlas in MS-DIAL 4. Nature Biotechnology 2020, 38 (10), 1159–1163. |
| Literature Reference DOI |
https://doi.org/10.1038/s41587-020-0531-2 |
| Precursor Ion |
[M+NH4]+ |
| SMILES |
CCCCCCCCCCCCCCCCCCC(=O)OC(CO)COP(O)(=O)OCC(CO)OC(=O)CCCCCCCCC |
| Sample Comments |
theoretical MS2 created from the information of SCIEX 5600 and 6600 with 45CE +-15CES |
