Chem
J-GLOBAL ID:200907059955211078
Nikkaji number:J16.718E
Algestone Acetophenide
アルゲストンアセトフェニド
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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:
C29 H36 O4
Molecular formula furigana:
C29-H36-O4
Molecular weight:
448.603
InChI:
InChI=1S/C29H36O4/c1-18(30)29-25(32-28(4,33-29)19-8-6-5-7-9-19)17-24-22-11-10-20-16-21(31)12-14-26(20,2)23(22)13-15-27(24,29)3/h5-9,16,22-25H,10-15,17H2,1-4H3/t22-,23+,24+,25-,26+,27+,28-,29-/m1/s1
InChI key:
AHBKIEXBQNRDNL-FVCOMRFXSA-N
SMILES:
CC(=O)[C@@]12O[C@@](C)(O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]21C)c1ccccc1
Systematic name (4):
16α,17-[(R)-1-フェニルエチリデンジオキシ]プレグナ-4-エン-3,20-ジオン
16α,17-[[(R)-1-フェニルエチリデン]ビス(オキシ)]プレグナ-4-エン-3,20-ジオン
(1R,2S,4R,6R,8S,9S,12S,13R)-8-アセチル-6,9,13-トリメチル-6-フェニル-5,7-ジオキサペンタシクロ[10.8.0.02,9 .04,8 .013,18 ]イコサ-17-エン-16-オン
(1R,2S,4R,6R,8S,9S,12S,13R)-8-acetyl-6,9,13-trimethyl-6-phenyl-5,7-dioxapentacyclo[10.8.0.02,9 .04,8 .013,18 ]icos-17-en-16-one
Other name (8):
ドロキソン
デラドロキソン
アルゲストンアセトフェニド
Droxone
SQ-15101
Deladroxone
Algestone acetophenide
16α,17-[[(R)-1-Phenylethylidene]bis(oxy)]pregn-4-ene-3,20-dione
Show all
CAS registry number:
24356-94-3
Regulation number (1):
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