Name | Value |
---|---|
55672-92-9 | |
InChI=1S/C21H36N7O16P3S/c1-21(2,16(31)19(32)24-4-3-12(29)23-5-6-48)8-41-47(38,39)44-46(36,37)40-7-11-15(43-45(33,34)35)14(30)20(42-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-31,48H,3-8H2,1-2H3,(H,23,29)(H,24,32)(H,36,37)(H,38,39)(H2,22,25,26)(H2,33,34,35)/t11-,14-,15-,16?,20-/m1/s1 | |
C21H36N7O16P3S | |
767.115208962 | |
O=P(O)(O)OC1C(O)C(OC1COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(O)=NCCC(O)=NCCS)N2C=NC=3C(=NC=NC32)N | |
RGJOEKWQDUBAIZ-DRCCLKDXSA-N |
Name | Value |
---|---|
ESI | |
Commercial | |
Orbitrap | |
767.115 | |
-1 | |
MSV000084496/peak/mzXML/GNPS00007_G11_n.mzXML | |
MS2 | |
GNPS-MSMLS | |
Dorrestein, mpanitchpakdi, Kelly Weldon | |
negative | |
3.241404547376675 | |
0.9352716532030527 | |
766.108 | |
[M-H]- | |
0.08750463380804041 ppm | |
6.703799999741022E-5 Da |