Marvin  07151114542D          

 25 28  0  0  1  0            999 V2000
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   10.0258  -15.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.3113  -13.2761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8824  -15.7511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7402  -14.9261    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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    7.1679  -15.3386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.3113  -15.7511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5249  -12.1962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 14 12  1  0  0  0  0
 14  1  1  0  0  0  0
  8 10  1  0  0  0  0
  8  2  1  0  0  0  0
 12 23  1  0  0  0  0
 12  3  1  0  0  0  0
  4  1  1  0  0  0  0
 10 16  1  0  0  0  0
 10  5  1  0  0  0  0
  2 22  1  0  0  0  0
 16 21  1  0  0  0  0
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 21  7  2  0  0  0  0
  6 18  1  0  0  0  0
  7 19  1  0  0  0  0
 23  4  1  0  0  0  0
  3  5  1  0  0  0  0
 22 21  1  0  0  0  0
 18 19  1  0  0  0  0
  8  9  1  1  0  0  0
 10 11  1  6  0  0  0
 12 13  1  1  0  0  0
 14 15  1  6  0  0  0
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 19 20  2  0  0  0  0
 23 24  1  6  0  0  0
M  END
> <ID>
CHEBI:27436

> <NAME>
methyltestosterone

> <DEFINITION>
A 17β-hydroxy steroid that is testosterone bearing a methyl group at the 17α position.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:25344; CHEBI:6892

> <SYNONYM>
NSC-9701; Methyltestosterone; 4-androstene-17alpha-methyl-17beta-ol-3-one; 17beta-hydroxy-17-methylandrost-4-en-3-one; 17alpha-methyltestosterone; 17alpha-methyl-Delta(4)-androsten-17beta-ol-3-one; 17alpha-methyl-3-oxo-4-androsten-17beta-ol; 17-methyltestosterone; 17-beta-hydroxy-17-methylandrost-4-en-3-one; 17(alpha)-methyl-Delta(4)-androsten-17(beta)-ol-3-one

> <IUPAC_NAME>
(17beta)-17-hydroxy-17-methylandrost-4-en-3-one

> <INN>
metiltestosterona; methyltestosteronum; methyltestosterone

> <BRAND_NAME>
Virilon; Testred; Android

> <FORMULA>
C20H30O2

> <MASS>
302.45100

> <MONOISOTOPIC_MASS>
302.22458

> <CHARGE>
0

> <SMILES>
[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1(C)O

> <INCHI>
InChI=1S/C20H30O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h12,15-17,22H,4-11H2,1-3H3/t15-,16+,17+,18+,19+,20+/m1/s1

> <INCHIKEY>
GCKMFJBGXUYNAG-HLXURNFRSA-N

> <CAS_REGISTRY_NUMBER>
58-18-4

> <REAXYS_REGISTRY_NUMBER>
2057425

> <CHEMIDPLUS>
58-18-4

> <DRUGBANK_ACCESSION>
DB06710

> <KEGG_COMPOUND_ACCESSION>
C07198

> <KEGG_DRUG_ACCESSION>
D00408

> <PUBMED_CITATION>
19199316

$$$$