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Hydroxyprogesterone Caproate

PubChem CID: 169870

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Compound Synonyms HYDROXYPROGESTERONE CAPROATE, 630-56-8, Primolut Depot, Hydroxyprogesterone hexanoate, Proge, Hormofort, Syngynon, Depo-Proluton, Proluton Depot, Teralutil, Delalutin, Estralutin, Hylutin, Hyproval, Kaprogest, Relutin, Lutate, Makena, Neolutin forte, Progesterone caproate, 17-Caproxyprogesterone, Duraluton, Idrogestene, Luteocrin, Lutopron, Hyroxon, Luteocrin depot, Hyproval-PA, Corlutin L.A., 17alpha-Hydroxyprogesterone caproate, NSC-17592, Gestiva, Procyte depo, 17-OHPC, 17alpha-Caproyloxypregn-4-ene-3,20-dione, 17-alpha-hydroxy-progesterone caproate, Progesterone retard pharlon, Gesterol LA 250, Caproate d'hydroxyprogesterone, 17-alpha-Hydroxyprogesterone caproate, Caproato de hidroxiprogesterona, Oxiprogesterone Caproate, Idroprogesterone caproato, 17-((1-Oxohexyl)oxy)pregn-4-ene-3,20-dione, 17alpha-Hydroxyprogesterone hexanoate, Progesterone, 17-hydroxy-, hexanoate, MLS000028438, 17a-hydroxyprogesterone caproate, DTXSID6043915, UNII-276F2O42F5, 17-Hydroxypregn-4-ene-3,20-dione hexanoate, EINECS 211-138-8, 17 alpha-hydroxyprogesterone caproate, 17-alpha-Hydroxyprogesterone hexanoate, 17.alpha.-caproyloxy-p4, 17alpha-Hydroxyprogesterone n-caproate, 276F2O42F5, Pregn-4-ene-3,20-dione, 17-hydroxy-, hexanoate, Pregn-4-ene-3,20-dione, 17-((1-oxohexyl)oxy)-, 17-alpha-Hydroxy progesterone n-caproate, SMR000058336, MLS001148643, CHEBI:5812, 3,20-Dioxo-4-pregnen-17alpha-yl hexanoat, 3,20-Dioxopregn-4-en-17alpha-yl caproate, 17alpha-Hydroxyprogesterone-17alpha caproate, DTXCID4023915, 17-alpha-Hexanoyloxypregn-4-ene-3,20-dione, NSC17592, 17-alpha hydroxyprogesterone caproate, 17.alpha.-Hydroxyprogesterone caproate, (8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl hexanoate, 17.alpha.-Hydroxyprogesterone hexanoate, Hydroxyprogesteroni caproas [INN-Latin], NCGC00021268-03, 17.alpha.-Hydroxyprogesterone n-caproate, Hexanoic acid, ester with 17-hydroxypregn-4-ene-3,20-dione, Caproate d'hydroxyprogesterone [INN-French], Hydroxyprogesterone caproate [USP:INN:JAN], Caproato de hidroxiprogesterona [INN-Spanish], 3,20-Dioxopregn-4-en-17.alpha.-yl caproate, [(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate, 17.alpha.-Hydroxypregn-4-ene-3,20-dione hexanoate, Pregn-4-ene-3,20-dione, 17-[(1-oxohexyl)oxy]-, Hydroxyprogesteroni caproas (INN-Latin), Delalutin (TN), 17P, CAS-630-56-8, Caproate d'hydroxyprogesterone (INN-French), HYDROXYPROGESTERONE CAPROATE (MART.), Hydroxyprogesterone caproate (USP:INN:JAN), HYDROXYPROGESTERONE CAPROATE [MART.], HYDROXYPROGESTERONE CAPROATE (USP-RS), HYDROXYPROGESTERONE CAPROATE [USP-RS], Caproato de hidroxiprogesterona (INN-Spanish), 17, A-Hydroxyprogesterone caproate, 17alpha-Caproyloxyprogesterone, HYDROXYPROGESTERONE CAPROATE (USP MONOGRAPH), HYDROXYPROGESTERONE CAPROATE [USP MONOGRAPH], Hydroxyprogesteroni caproas, Lewntogest, Idroprogesterone caproato [DCIT], 17, A-Hydroxyprogesterone hexanoate, Hyproval P.A., Hylutin (TN), Makena (TN), MFCD00072134, Progesterone, hexanoate, Opera_ID_1479, Deluteval 2X (Salt/Mix), SCHEMBL5330, 17alpha-CAPROYLOXY-P4, MLS002207289, 17-hydroxyprogesterone-caproate, cid_169870, CHEMBL1200848, BDBM70293, HY-B0742R, 17a-Hydroxyprogesterone hexanoate, 17alpha-Hydroxyprogesteron-Caproat, HMS2230L08, BCP16081, HY-B0742, Tox21_113502, Tox21_302333, s4674, AKOS005267159, Tox21_113502_1, 17 alpha -Hydroxyprogesterone Caproate, CCG-268987, DB06789, FH35175, GS-3233, Hydroxyprogesterone caproate (Standard), NCGC00021268-04, NCGC00255784-01, (1S,11S,15S,2R,10R,14R)-14-acetyl-2,15-dimethyl-5-oxotetracyclo[8.7.0.0<2,7>.0 <11,15>]heptadec-6-en-14-yl hexanoate, HYDROXYPROGESTERONE CAPROATE [INN], HYDROXYPROGESTERONE CAPROATE [JAN], Pregn-4-ene-3, 17-hydroxy-, hexanoate, 17alpha-hexanoyloxy-4pregnene-3,20-dione, Hydroxyprogesterone caproate (JAN/USP/INN), HYDROXYPROGESTERONE CAPROATE [VANDF], Pregn-4-ene-3, 17-[(1-oxohexyl)oxy]-, 17-Hydroxypregn-4-ene-3,20-dione caproate, H0994, HYDROXYPROGESTERONE CAPROATE [WHO-DD], NS00021273, 17alpha-Hydroxyprogesterone hexanoate, >=98%, C08148, D00949, H10189, 17-.alpha.-Hexanoyloxypregn-4-ene-3,20-dione, 17alpha-Hydroxypregn-4-ene-3,20-diene Caproate, EN300-7422372, 17alpha-Hydroxyprogesterone caproate [Progestins], 3,20-Dioxopregn-4-en-17.alpha.-yl hexanoate #, HYDROXYPROGESTERONE CAPROATE [ORANGE BOOK], SR-01000003075, 17.alpha.-Hydroxypregn-4-ene-3,20-dione caproate, 17.ALPHA.-HYDROXYPROGESTERONE CAPROATE [MI], Q3792032, SR-01000003075-3, 17alpha-HYDROXYPREGN-4-ENE-3,20-DIONE HEXANOATE, 17-Hydroxyprogesterone hexanoate, 17-Hydroxyprogesterone caproate, Hydroxyprogesterone caproate, United States Pharmacopeia (USP) Reference Standard, (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl hexanoate, (1S,2R,10R,11S,14R,15S)-14-acetyl-2,15-dimethyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-14-yl hexanoate, [(10R,13S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate, 211-138-8
Topological Polar Surface Area 60.4
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 31.0
Isotope Atom Count 0.0
Molecular Complexity 797.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 6.0
Uniprot Id P02545, P42858, Q16637, P10636, Q16665, Q9F4F7, P02791, Q03164, Q6W5P4, P51450, Q16236, Q9UIF8, P11473, P9WMR3, P9WHJ3, P84022, O75496, Q99700, P43220, Q9NUW8, P37840, O75874, Q9Y6L6, Q9NPD5, Q03431, P63092, P06401, P06186, n.a., P0DTD1, P10275, Q03181, P04792, P19838, P05412
Iupac Name [(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] hexanoate
Prediction Hob 0.0
Target Id NPT483, NPT1197, NPT93, NPT51, NPT211, NPT1416
Xlogp 5.7
Molecular Formula C27H40O4
Prediction Swissadme 0.0
Inchi Key DOMWKUIIPQCAJU-LJHIYBGHSA-N
Fcsp3 0.8148148148148148
Logs -5.151
Rotatable Bond Count 7.0
Logd 4.402
Compound Name Hydroxyprogesterone Caproate
Prediction Hob Swissadme 0.0
Exact Mass 428.293
Formal Charge 0.0
Monoisotopic Mass 428.293
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 428.6
Covalent Unit Count 1.0
Total Atom Stereocenter Count 6.0
Total Bond Stereocenter Count 0.0
Esol -5.601200600000002
Inchi InChI=1S/C27H40O4/c1-5-6-7-8-24(30)31-27(18(2)28)16-13-23-21-10-9-19-17-20(29)11-14-25(19,3)22(21)12-15-26(23,27)4/h17,21-23H,5-16H2,1-4H3/t21-,22+,23+,25+,26+,27+/m1/s1
Smiles CCCCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)C(=O)C
Nring 4.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Chaenomeles Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 2. Outgoing r'ship FOUND_IN to/from Polyalthia Nemoralis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 3. Outgoing r'ship FOUND_IN to/from Thlaspi Arvense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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