Name | Value |
---|---|
C29H46O12 | |
586.298926912 | |
O=C1OCC(C1)C2CCC3(O)C4CCC5(O)CC(OC6OC(C)C(O)C(O)C6O)CC(O)C5(CO)C4C(O)CC23C | |
InChI=1S/C29H46O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h13-19,21-25,30-32,34-38H,3-12H2,1-2H3/t13-,14?,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1 | |
ZTFGOPUOTATSAL-CFVDWFIMSA-N |
Name | Value |
---|---|
LC-ESI | |
NIH Pharmacologically Active Library | |
qTof | |
586.299 | |
1 | |
p4-F06_GF6_01_18390.mzXML | |
MS2 | |
GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE | |
VP/LMS, vphelan, Dorrestein | |
positive | |
6.248912758182875 | |
0.9324007330574696 | |
587.311 | |
[M+H]+ | |
6.9862270587116 ppm | |
0.004103088000078969 Da |