Name | Value |
---|---|
NADH | |
665.124 | |
C21H29N7O14P2 | |
665.124771868 | |
O=C(N)C1=CN(C=CC1)C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(N4C=NC=5C(=NC=NC54)N)C(O)C3O)C(O)C2O | |
InChI=1S/C21H29N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1,3-4,7-8,10-11,13-16,20-21,29-32H,2,5-6H2,(H2,23,33)(H,34,35)(H,36,37)(H2,22,24,25)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 | |
BOPGDPNILDQYTO-NNYOXOHSSA-N |
External Identifier | Value |
---|---|
58-68-4 | |
C00004 | |
439153 |
Name | Value |
---|---|
ESI | |
PS047201 | |
Sawada Y, Matsuda F, and Hirai MY. Plant Science Center, RIKEN | |
Copyright(C) 2008 Plant Science Center, RIKEN | |
Sawada et al Widely targeted metabolomics based on large-scale MS/MS data for elucidating metabolite accumulation patterns in plants. Plant Cell Physiol(2009) 50:37-47:doi:10.1093/pcp/pcn183 | |
TQD, Waters | |
Flow-injection QqQ/MS | |
Q | |
Q | |
LOW-ENERGY CID | |
10 | |
Q | |
CENTROID | |
[M+H]+ | |
MS2 | |
positive | |
0.0 | |
NaN | |
666.57 | |
[M+H]+ | |
655.9823154357543 ppm | |
0.43725813200001085 Da |