Chem
J-GLOBAL ID:200907016587884538   Nikkaji number:J2.060.723H

2-(Diethoxyphosphinyl)-5,9-dimethyl-11-[(4S)-2,2,5-trimethyl-5β-(2-oxoethyl)-1,3-dioxolane-4β-yl]-4,8-undecadienoic acid ethyl ester

2-(ジエトキシホスフィニル)-5,9-ジメチル-11-[(4S)-2,2,5-トリメチル-5β-(2-オキソエチル)-1,3-ジオキソラン-4β-イル]-4,8-ウンデカジエン酸エチル
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: C27H47O8P
Molecular formula furigana: C27-H47-O8-P
Molecular weight: 530.639
InChI: InChI=1S/C27H47O8P/c1-9-31-25(29)23(36(30,32-10-2)33-11-3)17-15-21(4)13-12-14-22(5)16-18-24-27(8,19-20-28)35-26(6,7)34-24/h14-15,20,23-24H,9-13,16-19H2,1-8H3/t23?,24-,27+/m0/s1
InChI key: QSSJZUYJCDGHFU-BQYSROJOSA-N
SMILES: CCOC(=O)C(CC=C(C)CCC=C(C)CC[C@@H]1OC(C)(C)O[C@]1(C)CC=O)P(=O)(OCC)OCC
Systematic name  (3):
  • 2-(ジエトキシホスフィニル)-5,9-ジメチル-11-[(4S)-2,2,5-トリメチル-5β-(2-オキソエチル)-1,3-ジオキソラン-4β-イル]-4,8-ウンデカジエン酸エチル
  • エチル 2-(ジエトキシホスホリル)-5,9-ジメチル-11-[(4S,5R)-2,2,5-トリメチル-5-(2-オキソエチル)-1,3-ジオキソラン-4-イル]ウンデカ-4,8-ジエノアート
  • ethyl 2-(diethoxyphosphoryl)-5,9-dimethyl-11-[(4S,5R)-2,2,5-trimethyl-5-(2-oxoethyl)-1,3-dioxolan-4-yl]undeca-4,8-dienoate
Other name (1):
  • 2-(Diethoxyphosphinyl)-5,9-dimethyl-11-[(4S)-2,2,5-trimethyl-5β-(2-oxoethyl)-1,3-dioxolane-4β-yl]-4,8-undecadienoic acid ethyl ester
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