Chem
J-GLOBAL ID:200907043193704540
Nikkaji number:J2.006.388B
2-Ethyl-3,17β-bis(sulfamoyloxy)estra-1,3,5(10)-triene
2-エチル-3,17β-ビス(スルファモイルオキシ)エストラ-1,3,5(10)-トリエン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C20 H30 N2 O6 S2
Molecular formula furigana:
C20-H30-N2-O6-S2
Molecular weight:
458.590
InChI:
InChI=1S/C20H30N2O6S2/c1-3-12-10-16-13(11-18(12)27-29(21,23)24)4-5-15-14(16)8-9-20(2)17(15)6-7-19(20)28-30(22,25)26/h10-11,14-15,17,19H,3-9H2,1-2H3,(H2,21,23,24)(H2,22,25,26)/t14-,15+,17-,19-,20-/m0/s1
InChI key:
LDOGEZTUWBORPG-SSGANFLRSA-N
SMILES:
CCc1cc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2cc1OS(=O)(=O)N)OS(=O)(=O)N
Systematic name (4):
2-エチル-3,17β-ビス(スルファモイルオキシ)エストラ-1,3,5(10)-トリエン
3,17β-ビス(スルファモイルオキシ)-2-エチルエストラ-1(10),2,4-トリエン
(1S,3aS,3bR,9bS,11aS)-8-エチル-11a-メチル-7-(スルファモイルオキシ)-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル スルファマート
(1S,3aS,3bR,9bS,11aS)-8-ethyl-11a-methyl-7-(sulfamoyloxy)-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl sulfamate
Other name (2):
2-Ethyl-3,17β-bis(sulfamoyloxy)estra-1,3,5(10)-triene
3,17β-Bis(sulfamoyloxy)-2-ethylestra-1(10),2,4-triene
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