Name | Value |
---|---|
50-24-8 | |
C21H28O5 | |
360.193673996 | |
O=C1C=CC2(C(=C1)CCC3C4CCC(O)(C(=O)CO)C4(C)CC(O)C32)C | |
InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16+,18-,19-,20-,21+/m0/s1 | |
OIGNJSKKLXVSLS-KYWYDSBTSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
qTof | |
360.194 | |
1 | |
Plate4_41_60_GH4_01_16505.mzXML | |
MS2 | |
GNPS-SELLECKCHEM-FDA-PART2 | |
negarg, Garg_Neha, Dorrestein | |
positive | |
5.708796544168458 | |
0.8286117838725571 | |
361.201 | |
[M+H]+ | |
1.7829297259728798 ppm | |
-6.439959999511302E-4 Da |