4-Methyl-4,6-androstadiene-3,17,19-trione

HCID 53720057
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Basic information

Standard SMILES
CC1=C2C=C[C@@H]3[C@H](CC[C@]4(C)C(=O)CC[C@@H]34)[C@@]2(C=O)CCC1=O
InChIKey
CGQUQXOTAASTSN-UTAYDHNUSA-N
Molecular formula
C20H24O3
Average molar mass
312.4 g/mol

Names & identifiers

Preferred name
4-Methyl-4,6-androstadiene-3,17,19-trione
IUPAC
(8R,9S,10S,13S,14S)-4,13-dimethyl-3,17-dioxo-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde

Names & synonyms

SCHEMBL11437665CGQUQXOTAASTSN-UTAYDHNUSA-N4-methyl-4,6-androstadiene-3,17,19-trione

Database identifiers

PubChem CID
53720057

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
51.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
23

Related reactions

10 records
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Linked notes

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