Structure database (LMSD)

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LM IDLMST02020007
Common NameAndrostenedione (W)
Systematic Nameandrost-4-ene-3,17-dione
Synonyms-
Exact Mass
286.1933 (neutral)    Calculate m/z:
FormulaC19H26O2
CategorySterol Lipids [ST]
Main ClassSteroids [ST02]
Sub ClassC19 steroids (androgens) and derivatives [ST0202]
LIPIDBANK IDSST0028
PubChem CID6128
KEGG IDC00280
HMDB IDHMDB0000053
CHEBI ID16422
SWISSLIPIDS IDSLM:000001060
CAYMAN ID9001311
InChIKeyAEMFNILZOJDQLW-QAGGRKNESA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(1
4)18/h11,14-16H,3-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
SMILESC1[C@]2(C)[C@@]3([H])CC[C@]4(C)C(=O)CC[C@@]4([H])[C@]3([H])CCC2=CC(=O)C1
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms21Rings4Aromatic Rings0Rotatable Bonds0
 van der Waals
Molecular Volume
297.48Topological Polar
Surface Area
34.14Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
2
 logP4.09Molar
Refractivity
81.72