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Neuroscience Information Framework (NIF) Standard Ontology
Last uploaded:
February 10, 2018
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| Preferred Name | testolactone | |
| Synonyms |
D-homo-17a-oxaandrosta-1,4-diene-3,17-dione (4aS,4bR,10aR,10bS,12aS)-10a,12a-dimethyl-3,4,4a,5,6,10a,10b,11,12,12a-decahydro-2H-naphtho[2,1-f]chromene-2,8(4bH)-dione 13-hydroxy-3-oxo-13,17-secoandrosta-1,4-dien-17-oic acid delta-lactone 1-dehydrotestololactone 1,2-didehydrotestololactone Delta(1)-testololactone Teslac Testolactone 3-oxo-13,17-secoandrosta-1,4-dieno-17,13alpha-lactone |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_9460 |
|
| alternative label |
D-homo-17a-oxaandrosta-1,4-diene-3,17-dione (4aS,4bR,10aR,10bS,12aS)-10a,12a-dimethyl-3,4,4a,5,6,10a,10b,11,12,12a-decahydro-2H-naphtho[2,1-f]chromene-2,8(4bH)-dione 13-hydroxy-3-oxo-13,17-secoandrosta-1,4-dien-17-oic acid delta-lactone 1-dehydrotestololactone 1,2-didehydrotestololactone Delta(1)-testololactone Teslac Testolactone 3-oxo-13,17-secoandrosta-1,4-dieno-17,13alpha-lactone
|
|
| charge |
0
|
|
| database_cross_reference |
CAS:968-93-4 KEGG:D00153 DrugBank:DB00894 KEGG:C02197 Wikipedia:Testolactone Drug_Central:2606 Beilstein:36921
|
|
| formula |
C19H24O3
|
|
| has exact synonym |
Testolactone 3-oxo-13,17-secoandrosta-1,4-dieno-17,13alpha-lactone
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
D-homo-17a-oxaandrosta-1,4-diene-3,17-dione (4aS,4bR,10aR,10bS,12aS)-10a,12a-dimethyl-3,4,4a,5,6,10a,10b,11,12,12a-decahydro-2H-naphtho[2,1-f]chromene-2,8(4bH)-dione 13-hydroxy-3-oxo-13,17-secoandrosta-1,4-dien-17-oic acid delta-lactone 1-dehydrotestololactone 1,2-didehydrotestololactone Delta(1)-testololactone Teslac
|
|
| id |
CHEBI:9460
|
|
| in_subset | ||
| inchi |
InChI=1S/C19H24O3/c1-18-9-7-13(20)11-12(18)3-4-14-15(18)8-10-19(2)16(14)5-6-17(21)22-19/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15+,16+,18+,19+/m1/s1
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|
| inchikey |
BPEWUONYVDABNZ-DZBHQSCQSA-N
|
|
| label |
testolactone
|
|
| mass |
300.39206
|
|
| monoisotopicmass |
300.17254
|
|
| notation |
CHEBI:9460
|
|
| preferred label |
testolactone
|
|
| prefLabel |
testolactone
|
|
| smiles |
[H][C@@]12CCC3=CC(=O)C=C[C@]3(C)[C@@]1([H])CC[C@]1(C)OC(=O)CC[C@@]21[H]
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| subClassOf |
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