General Information of the Compound
| Compound ID |
CP0044042
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| Compound Name |
(1S,10R,11S,15S)-5-hydroxy-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2,4,6-trien-14-one
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| Synonyms |
(13S)-3-hydroxy-13-methyl-7,8,9,11,12,13,15,16-octahydro-6H-cyclopenta[a]phenanthren-17(14H)-one
(8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
1,3,5(10)-Estratrien-3-ol-17-one
1,3,5(10)-Oestratrien-3-ol-17-one
3-Hydroxy-1,3,5(10)-estratrien-17-one
3-Hydroxy-17-keto-estra-1,3,5-triene
3-Hydroxy-17-keto-oestra-1,3,5-triene
3-Hydroxy-oestra-1,3,5(10)-trien-17-one
3-Hydroxyestra-1,3,5(10)-trien-17-one
3-Hydroxyestra-1,3,5(10)-triene-17-one
3-hydroxy-estra-1,3,5(10)-trien-17-one
Aquacrine
CMC_13458
Crinovaryl
Cristallovar
Crystogen
Delta-1,3,5-Estratrien-3beta-ol-17-one
Delta-1,3,5-Oestratrien-3beta-ol-17-one
Delta-1,3,5-estratrien-3-beta-ol-17-one
Delta-1,3,5-oestratrien-3-beta-ol-17-one
Destrone
Disynformon
E 9750
E(sub 1)
E0026
Endofolliculina
Esterone
Estrin
Estrogenic Substance
Estrol
Estron
Estrona
Estrona [INN-Spanish]
Estrona [Spanish]
Estrone
Estrone (E1)
Estrone (JAN/USP/INN)
Estrone (TN)
Estrone [USAN:INN]
Estrone, (+-)-Isomer
Estrone, (8 alpha)-Isomer
Estrone, (9 beta)-Isomer
Estrone-A
Estronum
Estronum [INN-Latin]
Estrovarin
Estrugenone
Estrusol
Femestrone injFemestrone injection
Femidyn
Fermidyn
Folikrin
Folipex
Folisan
Follestrine
Follestrol
Follicular hormone
Folliculin
Folliculine
Folliculine benzoate
Follicunodis
Glandubolin
Hauck Brand of Estrone
Hiestrone
Hormestrin
Hormofollin
Hormovarine
Hyrex Brand of Estrone
Kestrone
Ketodestrin
Ketohydroxy-Estratriene
Ketohydroxyestrin
Ketohydroxyoestrin
Ketophydroxyestrin
Kolpon
Menagen
Menformon
Menformon A
Mestronaq
NATURAL ESTROGENIC SUBSTANCE-ESTRONE
OESTRONE
Oestrin
Oestroform
Oestrone [Steroidal oestrogens]
Oestrone, Estrone
Oestronum
Oestroperos
Ovex (tablets)
Ovifollin
Penncap M
Perlatan
Solliculin
Theelin
Thelestrin
Thelykinin
Thynestron
Tokokin
Unden
Unden (pharmaceutical)
Unden (pharmaceutical) (VAN)
Unigen
Vortech Brand of Estrone
Wehgen
Wynestron
WynestronPencap M
[2,4,6,7-3H]-E1
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| Structure |
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| Formula |
C18H22O2
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| Molecular Weight |
270.372
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| Canonical SMILES |
C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CCC2=O
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| InChI |
InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1
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| InChIKey |
DNXHEGUUPJUMQT-CBZIJGRNSA-N
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| CAS |
53-16-7
37242-41-4
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01498, 17-beta-hydroxysteroid dehydrogenase type 1
Protein ID: PT02718, Broad substrate specificity ATP-binding cassette transporter ABCG2
Protein ID: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta
Protein ID: PT06135, Solute carrier organic anion transporter family member 1A1
Clinical Information about the Compound