Go to resource

Cholesteryl linoleate

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_N102524_02B7

Dataset description:

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_N102524_02B7 contains the MS2 mass spectrum of Cholesteryl linoleate with the InChIkey NAACPBBQTFFYQB-LJAITQKLSA-N.

Source: Cholesteryl linoleate

Chemical Info

molecular Image

InChI	InChI=1S/C45H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h11-12,14-15,26,35-36,38-42H,7-10,13,16-25,27-34H2,1-6H3/b12-11-,15-14-/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1
SMILES	CCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C
InChI Key	NAACPBBQTFFYQB-LJAITQKLSA-N
Molecular Formula	C45H76O2
Exact Mass	648.585 g/mol

There are no views created for this resource yet.

Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	No License Provided
Id	3a940cc2-0359-4f8c-b017-6a601a7e1ddc
Package id	msbnk-antwerp_univ-metox_n102524_02b7
Resource type	HTML
State	active