CID 134822640

14alpha-hydroxymethylsteroid

Structural Information

Molecular Formula
C20H34O
SMILES
CC12CCC[C@]1(C3CCC4CCCCC4(C3CC2)C)CO
InChI
InChI=1S/C20H34O/c1-18-10-5-12-20(18,14-21)17-8-7-15-6-3-4-11-19(15,2)16(17)9-13-18/h15-17,21H,3-14H2,1-2H3/t15?,16?,17?,18?,19?,20-/m1/s1
InChIKey
SXLXTCWGXBLWCM-NSDIEPNESA-N
Compound name
[(14R)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-14-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.26096 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.268236 177.7
[M+Na]+ 313.250178 181.0
[M-H]- 289.253684 179.9
[M+NH4]+ 308.294783 202.6
[M+K]+ 329.224118 174.8
[M+H-H2O]+ 273.258220 170.6
[M+HCOO]- 335.259161 185.2
[M+CH3COO]- 349.274811 185.6
[M+Na-2H]- 311.235626 178.4
[M]+ 290.26041142 167.8
[M]- 290.26150858 167.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.