Name | Value |
---|---|
Steroid | |
InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3/b10-9+,23-12+,24-13-/t20-,22+,25-,26+,27-,28+/m0/s1 | |
MECHNRXZTMCUDQ-RKHKHRCZSA-N | |
C28H44O | |
396.33921602799995 | |
OC1CC(=CC=C2CCCC3(C)C2CCC3C(C=CC(C)C(C)C)C)C(=C)CC1 |
External Identifier | Value |
---|---|
50-14-6 | |
4444351 | |
C05441 | |
VVD0351 | |
LMST03010001 | |
5280793 |
Name | Value |
---|---|
PR100476 | |
2016.01.19 (Created 2009.09.10, modified 2011.05.06) | |
Matsuda F, Suzuki M, Sawada Y, Plant Science Center, RIKEN. | |
CC BY-SA | |
Acquisition and generation of the data is financially supported in part by CREST/JST. | |
396.33922 | |
UPLC Q-Tof Premier, Waters | |
LC-ESI-QTOF | |
MS2 | |
Ramp 5-60 V | |
Continuum | |
600.0 L/Hr | |
400 C | |
LOW-ENERGY CID | |
ESI | |
120 C | |
3.0 kV | |
23.0 V | |
CH3CN(0.1%HCOOH)/ H2O(0.1%HCOOH) | |
positive | |
2.4471632064652726 | |
0.780471287120553 | |
397.347 | |
[M+H]+ | |
0.46817517175981793 ppm | |
-1.8602799997324837E-4 Da |