Chem
J-GLOBAL ID:200907024832806133
Nikkaji number:J475.131K
EM-140
N-ブチル-N-メチル-3,17β-ジヒドロキシエストラ-1,3,5(10),14-テトラエン-7α-ウンデカンアミド
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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:
C34 H53 NO3
Molecular formula furigana:
C34-H53-N-O3
Molecular weight:
523.802
InChI:
InChI=1S/C34H53NO3/c1-4-5-22-35(3)32(38)15-13-11-9-7-6-8-10-12-14-25-23-26-24-27(36)16-17-28(26)29-20-21-34(2)30(33(25)29)18-19-31(34)37/h16-18,24-25,29,31,33,36-37H,4-15,19-23H2,1-3H3/t25-,29-,31+,33-,34+/m1/s1
InChI key:
GGAGTAFPCNHREY-FCXJYDKGSA-N
SMILES:
CCCCN(C)C(=O)CCCCCCCCCC[C@@H]1Cc2cc(O)ccc2[C@H]2CC[C@]3(C)[C@@H](O)CC=C3[C@H]12
Systematic name (3):
N-ブチル-N-メチル-3,17β-ジヒドロキシエストラ-1,3,5(10),14-テトラエン-7α-ウンデカンアミド
11-[(1S,3bR,4R,9bS,11aS)-1,7-ジヒドロキシ-11a-メチル-1H,2H,3bH,4H,5H,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-4-イル]-N-ブチル-N-メチルウンデカンアミド
11-[(1S,3bR,4R,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-4-yl]-N-butyl-N-methylundecanamide
Other name (1):
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