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3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate

MNXM819776 is deprecated and replaced by MNXM5033
PropertiesImageOccurences in reactions
MNX_IDMNXM5033Image of MNXM5033
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 2
formulaC13H17O4
charge-1
mass237.11323
referencechebi:63692
InChIKeyPCCFNLPWOFTZPJ-RVBZMBCESA-M
InChIInChI=1S/C13H18O4/c1-13-7-6-10(14)8(2-5-12(16)17)9(13)3-4-11(13)15/h8-9H,2-7H2,1H3,(H,16,17)/p-1/t8-,9-,13-/m0/s1
SMILESC[C@]12CCC(=O)[C@@H](CCC(=O)[O-])[C@@H]1CCC2=O
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Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:63692
chebi:63692
3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate
3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydroinden-4-yl]propanoate
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate(1-)
seed.compound:cpd21432
seedM:cpd21432
3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate
3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate
9,17-Dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid
DOHNAA
HIP
kegg.compound:C20199
keggC:C20199
3-[(3aS,4S,7aS)-7a-Methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate
9,17-Dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid
DOHNAA
HIP
metacyc.compound:CPD-13711
metacycM:CPD-13711
3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxo-octahydro-1H-inden-4-yl]propanoate
3aalpha-H-4alpha(3'-propanoate)-7abeta-methylhexahydro-1,5-indane-dione
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid
HIP
envipath:...adee43e9362b
envipathM:...adee43e9362b
9,17-Dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate
sabiork.compound:31144
sabiorkM:31144
9,17-Dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid
DOHNAA
CHEBI:63741
chebi:63741
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid
3-[(3aS,4S,7aS)-7a-methyl-1,5-dioxooctahydro-1H-inden-4-yl]propanoic acid
keggC:M_C20199
seedM:M_cpd21432
secondary/obsolete/fantasy identifier