Chem
J-GLOBAL ID:200907010784153318
Nikkaji number:J15.020G
Dexamethasone Isonicotinate
デキサメタゾンイソニコチナート
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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:
C28 H32 FNO6
Molecular formula furigana:
C28-H32-F-N-O6
Molecular weight:
497.563
InChI:
InChI=1S/C28H32FNO6/c1-16-12-21-20-5-4-18-13-19(31)6-9-25(18,2)27(20,29)22(32)14-26(21,3)28(16,35)23(33)15-36-24(34)17-7-10-30-11-8-17/h6-11,13,16,20-22,32,35H,4-5,12,14-15H2,1-3H3/t16-,20+,21+,22+,25+,26+,27+,28+/m1/s1
InChI key:
BQTXJHAJMDGOFI-NJLPOHDGSA-N
SMILES:
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)c1ccncc1
Systematic name (4):
9-フルオロ-11β,17,21-トリヒドロキシ-16α-メチルプレグナ-1,4-ジエン-3,20-ジオン21-イソニコチナート
9-フルオロ-11β,17-ジヒドロキシ-21-イソニコチノイルオキシ-16α-メチルプレグナ-1,4-ジエン-3,20-ジオン
2-[(1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-フルオロ-1,10-ジヒドロキシ-2,9a,11a-トリメチル-7-オキソ-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル]-2-オキソエチル ピリジン-4-カルボキシラート
2-[(1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl pyridine-4-carboxylate
Other name (10):
アウキシロソン
HE-111
Auxiloson
ボレン
デキサメタゾンイソニコチナート
Dexamethasone isonicotinate
Voren
9-Fluoro-11β,17-dihydroxy-21-isonicotinoyloxy-16α-methylpregna-1,4-diene-3,20-dione
9-Fluoro-11β,17,21-trihydroxy-16α-methylpregna-1,4-diene-3,20-dione 21-isonicotinate
イソニコチン酸デキサメタゾン
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CAS registry number:
2265-64-7
Regulation number (2):
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