testololactone
Chemical Formula:
C19H26O3
Molecular Weight:
302.413 Daltons
Monoisotopic Mass:
302.1881947009 Daltons
SMILES:
CC24(CCC(=O)C=C(CC[CH]1([CH]3(CCC(=O)OC(C)(CC[CH]12)3)))4)
InChI:
1S/C19H26O3/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/h11,14-16H,3-10H2,1-2H3/t14-,15+,16+,18+,19+/m1/s1
InChIKey:
Synonyms
- D-homo-17α-oxaandrost-4-ene-3,17-dione
- 17α-oxo-D-homoandrost-4-ene-3,17-dione
- hydrotestolactone
- 3-oxo-13,17-secoandrost-4-ene-17,13α-lactone
Databases
MetaCyc:
TESTOLOLACTONE
LIPID MAPS:
LMST02020061
ChemSpider:
141246
PubChem (CID):
160753
ChEBI:
18084
KEGG:
C04676
NCI:
12173
Seed:
cpd02850
MetaNetX:
MNXM1052
3DMET:
B01796
CAS:
4416-57-3