Chem
J-GLOBAL ID:200907011655921445
Nikkaji number:J11.257G
Tralonide
トラロニド
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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:
C24 H28 Cl2 F2 O4
Molecular formula furigana:
C24-H28-CL2-F2-O4
Molecular weight:
489.380
InChI:
InChI=1S/C24H28Cl2F2O4/c1-20(2)31-19-9-13-14-8-16(28)15-7-12(29)5-6-21(15,3)23(14,26)17(25)10-22(13,4)24(19,32-20)18(30)11-27/h5-7,13-14,16-17,19H,8-11H2,1-4H3/t13-,14-,16-,17-,19+,21-,22-,23-,24+/m0/s1
InChI key:
OGZHZYVCWDUIJV-VSXGLTOVSA-N
SMILES:
CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(Cl)[C@@H](Cl)C[C@]3(C)[C@@]2(O1)C(=O)CF
Systematic name (3):
9,11β-ジクロロ-6α,21-ジフルオロ-16α,17-[(1-メチルエチリデン)ビス(オキシ)]プレグナ-1,4-ジエン-3,20-ジオン
(1S,2S,4R,8S,9S,11S,12R,13S,19S)-11,12-ジクロロ-19-フルオロ-8-(2-フルオロアセチル)-6,6,9,13-テトラメチル-5,7-ジオキサペンタシクロ[10.8.0.02,9 .04,8 .013,18 ]イコサ-14,17-ジエン-16-オン
(1S,2S,4R,8S,9S,11S,12R,13S,19S)-11,12-dichloro-19-fluoro-8-(2-fluoroacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9 .04,8 .013,18 ]icosa-14,17-dien-16-one
Other name (3):
トラロニド
Tralonide
9,11β-Dichloro-6α,21-difluoro-16α,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione
CAS registry number:
21365-49-1
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