3beta-Acetoxy-5alpha-androstan-17-one
Daten werden ergänzt – meist innerhalb einer Minute fertig
Grundinformationen
- CAS
1239-31-2- Standard-SMILES
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]32)C1- InChIKey
FDCINQSOYQUNKB-HGDYXINXSA-N- Summenformel
- C21H32O3
- Durchschnittliche Molmasse
- 332,5 g/mol
- Monoisotopische Masse
- 332,23514488
Namen und Bezeichner
- Bevorzugter Name
- 3beta-Acetoxy-5alpha-androstan-17-one
- IUPAC
- [(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
Namen und Synonyme
3beta-Acetoxy-5alpha-androstan-17-oneDTXSID601305364RefChem:505555DTXCID301735352Epiandrosterone acetate1239-31-2Isoandrosterone acetateepi-Androsterone acetate17-Oxo-5alpha-androstan-3beta-yl acetate5alpha-Androstan-3beta-ol-17-one acetateAndrostan-17-one, 3-(acetyloxy)-, (3beta,5alpha)-5alpha-Androstan-17-one, 3beta-hydroxy-, acetate
Weitere Namen anzeigen
[(3S,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetateNSC 120612BRN 2625063NSC-120612Androstan-17-one, 3-(acetyloxy)-, (3b,5a)-(3-beta,5-alpha)-3-(Acetyloxy)androstan-17-one(3aS,3bR,5aS,7S,9aS,9bS,11aS)-9a,11a-dimethyl-1-oxo-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl acetateANDROSTEN-17-ONE, 3-beta-HYDROXY-, ACETATE
Datenbank-Bezeichner
- CAS
1239-31-2- PubChem CID
- 908740
- DTXSID
DTXSID601305364- ChEMBL
CHEMBL4632363- UNII
- MT8537SW7X
- EC Number
- 623-940-9
- Nikkaji
- J393.512D
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 4,3
- Polarare Oberfläche (TPSA)
- 43,4 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 24
- Formalladung
- 0
- Komplexität
- 555
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesChemical shift
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P203, P261, P271, P280, P302+P352, P304+P340, P317, P318, P321, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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