Chem
J-GLOBAL ID：200907089011367640   Nikkaji number：J34.278E

Alliacolide

アリアコリド
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： C15H22O4
Molecular formula furigana： C15-H22-O4
Molecular weight： 266.337
InChI： InChI=1S/C15H22O4/c1-8-5-6-13(17)9(2)10(16)18-14(13)7-12(3,4)11-15(8,14)19-11/h8-9,11,17H,5-7H2,1-4H3/t8-,9-,11-,13+,14+,15-/m1/s1
InChI key： LLRILYDNXOIONB-PMKYJIPRSA-N
SMILES： C[C@@H]1C(=O)O[C@]23CC(C)(C)[C@H]4O[C@@]24[C@H](C)CC[C@]13O
Systematic name  (3)：
  • (1aR,2R,7aS)-3,4,4a,5,9,9aα-ヘキサヒドロ-4aβ-ヒドロキシ-2α,5α,9,9-テトラメチル-8H-オキシレノ[1,7a]インデノ[3a,4-b]フラン-6(2H)-オン
  • (1S,4S,5S,8R,9R,11R)-5-ヒドロキシ-4,8,12,12-テトラメチル-2,10-ジオキサテトラシクロ[7.4.0.01,5.09,11]トリデカン-3-オン
  • (1S,4S,5S,8R,9R,11R)-5-hydroxy-4,8,12,12-tetramethyl-2,10-dioxatetracyclo[7.4.0.01,5.09,11]tridecan-3-one
Other name (3)：
  • アリアコリド
  • Alliacolide
  • (1aR,2R,7aS)-3,4,4a,5,9,9aα-Hexahydro-4aβ-hydroxy-2α,5α,9,9-tetramethyl-8H-oxireno[1,7a]indeno[3a,4-b]furan-6(2H)-one
CAS registry number： 66389-08-0
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM