Chem
J-GLOBAL ID：201007094923818257   Nikkaji number：J2.780.247H

Deoxyanisatin

デオキシアニサチン
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： C15H20O7
Molecular formula furigana： C15-H20-O7
Molecular weight： 312.318
InChI： InChI=1S/C15H20O7/c1-7-3-8(16)15(20)13(7)4-9(22-10(17)5-13)12(2,19)14(15)6-21-11(14)18/h7-9,16,19-20H,3-6H2,1-2H3/t7-,8-,9?,12+,13-,14+,15-/m1/s1
InChI key： LHLMFHLJVCWKPV-LOYGANHASA-N
SMILES： C[C@@H]1C[C@@H](O)[C@]2(O)[C@]3(COC3=O)[C@@](C)(O)[C@H]3C[C@@]12CC(=O)O3
Systematic name  (3)：
  • (6S)-4,5,6a,7,8,9-ヘキサヒドロ-5α,6aα,7α-トリヒドロキシ-5,9β-ジメチルスピロ[6H-4α,9aα-メタノシクロペンタ[d]オキソシン-6,3′-オキセタン]-2,2′(1H)-ジオン
  • (1'R,2'R,3S,4'R,5'R,7'R,8'R)-4',5',7'-トリヒドロキシ-2',7'-ジメチル-9'-オキサスピロ[オキセタン-3,6'-トリシクロ[6.3.1.01,5]ドデカン]-4,10'-ジオン
  • (1'R,2'R,3S,4'R,5'R,7'R,8'R)-4',5',7'-trihydroxy-2',7'-dimethyl-9'-oxaspiro[oxetane-3,6'-tricyclo[6.3.1.01,5]dodecane]-4,10'-dione
Other name (3)：
  • (6S)-4,5,6a,7,8,9-Hexahydro-5α,6aα,7α-trihydroxy-5,9β-dimethylspiro[6H-4α,9aα-methanocyclopenta[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione
  • Deoxyanisatin
  • デオキシアニサチン
KEGG COMPOUND： C12076
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM