Name | Value |
---|---|
InChI=1S/C34H54O8/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39)/t19-,21+,22+,23+,25+,26-,28+,31+,33-,34+/m1/s1 | |
C34H54O8 | |
590.381868688 | |
O=C(O)C1=C(O)C(=CC=C1CCC(C)C(O)C(C(=O)C(CC)C2OC(CC)(CC2C)C3OC(C)C(O)(CC)CC3)C)C | |
BBMULGJBVDDDNI-OWKLGTHSSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
Orbitrap | |
590.382 | |
1 | |
MSV0000083472_NIH_NP_QE_Pos2_0i1min_r80_mergeMSMS.mgf | |
MS2 | |
GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE | |
Pieter Dorrestein, mpanitchpakdi, lfnothias/robinschmid | |
positive | |
4.142927827958846 | |
0.8865995256245931 | |
573.379 | |
[M-H2O+H]+ | |
7.850500279923305 ppm | |
0.0045013120000021445 Da |