Chem
J-GLOBAL ID：200907081990688800   Nikkaji number：J2.032.116D

(1S)-2α-[[6-O-(4-Hydroxybenzoyl)-β-D-glucopyranosyloxy]methyl]-3-methylene-4β-(4-hydroxybenzoyloxy)cyclopentane-1α-ethanol

(1S)-2α-[[6-O-(4-ヒドロキシベンゾイル)-β-D-グルコピラノシルオキシ]メチル]-3-メチレン-4β-(4-ヒドロキシベンゾイルオキシ)シクロペンタン-1α-エタノール
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： C29H34O12
Molecular formula furigana： C29-H34-O12
Molecular weight： 574.579
InChI： InChI=1S/C29H34O12/c1-15-21(18(10-11-30)12-22(15)40-28(37)17-4-8-20(32)9-5-17)13-39-29-26(35)25(34)24(33)23(41-29)14-38-27(36)16-2-6-19(31)7-3-16/h2-9,18,21-26,29-35H,1,10-14H2/t18-,21+,22-,23+,24+,25-,26+,29+/m0/s1
InChI key： YMLXLKGCAAOOHQ-DXHLRWJUSA-N
SMILES： OCC[C@H]1C[C@H](OC(=O)c2ccc(O)cc2)C(=C)[C@H]1CO[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (1S)-2α-[[6-O-(4-ヒドロキシベンゾイル)-β-D-グルコピラノシルオキシ]メチル]-3-メチレン-4β-(4-ヒドロキシベンゾイルオキシ)シクロペンタン-1α-エタノール
  • (1S,3S,4S)-4-(2-ヒドロキシエチル)-2-メチリデン-3-({[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-[(4-ヒドロキシベンゾイルオキシ)メチル]オキサン-2-イル]オキシ}メチル)シクロペンチル 4-ヒドロキシベンゾアート
  • (1S,3S,4S)-4-(2-hydroxyethyl)-2-methylidene-3-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(4-hydroxybenzoyloxy)methyl]oxan-2-yl]oxy}methyl)cyclopentyl 4-hydroxybenzoate
Other name (1)：
  • (1S)-2α-[[6-O-(4-Hydroxybenzoyl)-β-D-glucopyranosyloxy]methyl]-3-methylene-4β-(4-hydroxybenzoyloxy)cyclopentane-1α-ethanol
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM