Chem
J-GLOBAL ID:200907049557388760   Nikkaji number:J1.992.976K

(9β)-3-Methoxy-17β-tert-butoxy-B-norestrane-1(10),2,4,8(14),11-pentene

(9β)-3-メトキシ-17β-tert-ブトキシ-B-ノルエストラン-1(10),2,4,8(14),11-ペンタエン
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: C22H28O2
Molecular formula furigana: C22-H28-O2
Molecular weight: 324.464
InChI: InChI=1S/C22H28O2/c1-21(2,3)24-20-9-8-19-18-13-14-12-15(23-5)6-7-16(14)17(18)10-11-22(19,20)4/h6-7,10-12,17,20H,8-9,13H2,1-5H3/t17-,20-,22-/m0/s1
InChI key: PMVNSOMNMSTORR-XJABCFGWSA-N
SMILES: COc1ccc2[C@@H]3C=C[C@]4(C)[C@H](CCC4=C3Cc2c1)OC(C)(C)C
Systematic name  (3):
  • (9β)-3-メトキシ-17β-tert-ブトキシ-B-ノルエストラン-1(10),2,4,8(14),11-ペンタエン
  • 2-{[(3S,3aS,5aR)-8-メトキシ-3a-メチル-1H,2H,3H,3aH,5aH,10H-シクロペンタ[a]フルオレン-3-イル]オキシ}-2-メチルプロパン
  • 2-{[(3S,3aS,5aR)-8-methoxy-3a-methyl-1H,2H,3H,3aH,5aH,10H-cyclopenta[a]fluoren-3-yl]oxy}-2-methylpropane
Other name (1):
  • (9β)-3-Methoxy-17β-tert-butoxy-B-norestrane-1(10),2,4,8(14),11-pentene
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