Sphingomyelin d18:0-C20:0
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Chubu_Univ-UT002001
Dataset description:
This MassBank record with Accession MSBNK-Chubu_Univ-UT002001 contains the MS2 mass spectrum of Sphingomyelin d18:0-C20:0 with the InChIkey UGRZESKDAPEULH-HLFYWILQSA-N.
Source: Sphingomyelin d18:0-C20:0
Chemical Info
InChI | InChI=1S/C43H89N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h41-42,46H,6-40H2,1-5H3,(H-,44,47,48,49)/t41-,42+/m1/s1 |
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SMILES | C(CCC)CCCCCCCCCCCC(O)C(COP([O-1])(=O)OCC[N+1](C)(C)C)NC(CCCCCCCCCCCCCCCCCCC)=O |
InChI Key | UGRZESKDAPEULH-HLFYWILQSA-N |
Molecular Formula | C43H89N2O6P |
Exact Mass | 760.646 g/mol |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | 83183d10-febe-4542-a405-8a2e3428a991 |
Package id | msbnk-chubu_univ-ut002001 |
Resource type | HTML |
State | active |