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Compound InformationSONAR Target prediction
Name:

DIHYDROJASMONIC ACID

Unique Identifier:SPE01504104
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:192.127 g/mol
X log p:-1.077  (online calculus)
Lipinksi Failures0
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:6
Canonical Smiles:CCCCCC1C(CCC1=O)CC(O)=O
Class:alkane
Source:Jasminium spp and Vicia faba
Reference:Helv Chim Acta 57: 1301 (1974); Tet Lett 3413 (1974); JACS 97: 6144 (1975); PNAS 98:
4788 (2001)
Therapeutics:plant growth regulator

Found: 205 nonactive as graph: single | with analogs [1] << Back 31 32 33 34 35 36 37 38 39 40  Next >> [205]
Species: 4932
Condition: GAS1
Replicates: 2
Raw OD Value: r im 0.3621±0.0422143
Normalized OD Score: sc h 1.0557±0.0064124
Z-Score: 0.5525±0.00602013
p-Value: 0.580586
Z-Factor: -13.7801
Fitness Defect: 0.5437
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:5|G6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.70 Celcius
Date:2006-01-20 YYYY-MM-DD
Plate CH Control (+):0.043775±0.00220
Plate DMSO Control (-):0.413725±0.04833
Plate Z-Factor:0.5811
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DBLink | Rows returned: 186[1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [31]
380736 2-(6-oxonorbornan-2-yl)acetic acid
407651 4-acetyl-4-methyl-heptanedioic acid
475446 n/a
494434 4a-methyl-8-oxo-decalin-2-carboxylic acid
519049 n/a
538087 2-(2-acetyl-5-methyl-cyclopentyl)acetic acid

internal high similarity DBLink | Rows returned: 131 2 3 Next >> 
SPE01500225 0.9130
JFD 01238 0.9130
JFD 01264 0.9167
BTBG 00035 0.9167
LOPAC 00965 0.9167
RJC 03406 0.9583

active | Cluster 11884 | Additional Members: 2 | Rows returned: 1
SPE01504910 0.25531914893617

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