Standard Detail: Acetyl coA

Chemical Information

Name Acetyl coA
Formula C23H38N7O17P3S
Inventory ID 74
Exact mass 809.12577
Solubility Methanol/IPA
Inchi InChI=1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38)/t13-,16-,17-,18+,22-/m1/s1

External reference numbers

ChEBI
lipidMAPS
CAS
Pubchem 444493
Vendor Sigma
Vendor Catalogue Number A2056
[M-H]-
Scan Number 944
Precursor m/z 808.11681
Retention time 1.73
Precursor Fraction 1.00
collision energy 33.33 electronvolt
[M-H]-
Scan Number 1039
Precursor m/z 808.11666
Retention time 1.90
Precursor Fraction 1.00
collision energy 33.33 electronvolt
[M-H]-
Scan Number 2962
Precursor m/z 808.11678
Retention time 5.49
Precursor Fraction 1.00
collision energy 33.33 electronvolt
[M-H]-
Scan Number 3332
Precursor m/z 808.11679
Retention time 6.18
Precursor Fraction 1.00
collision energy 33.33 electronvolt