Chemical Compound

[(2R,3S,4S,5R,6S)-6-{[(1R,2S,3R,5R,6R,8S)-2-[(benzoyloxy)methyl]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate

CAS Registry Number 262350-52-7
[(2R,3S,4S,5R,6S)-6-{[(1R,2S,3R,5R,6R,8S)-2-[(benzoyloxy)methyl]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate 结构式
Primary record

[(2R,3S,4S,5R,6S)-6-{[(1R,2S,3R,5R,6R,8S)-2-[(benzoyloxy)methyl]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate

库存
4,840 克
纯度
98.7 %
CAS
262350-52-7

化合物标识与属性

CAS
262350-52-7
PubChem CID
21593828
SMILES
C[C@]12C[C@@]3([C@@H]4C[C@]1([C@@]4([C@H](O2)O3)COC(=O)C5=CC=CC=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)COC(=O)C7=CC(=C(C=C7)O)OC)O)O)O)O
Canonical SMILES
COc1cc(C(=O)OC[C@H]2O[C@@H](O[C@]34C[C@@H]5[C@@]3(COC(=O)c3ccccc3)[C@H]3O[C@]5(O)C[C@]4(C)O3)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O

名称与同义词

  • Mudanpioside J
  • MudanpiosideJ
  • RefChem:159990
  • 262350-52-7
  • 6 -O-Vanillylpaeoniflorin
  • orb1680879
  • CHEMBL2205291
  • SCHEMBL29530848
  • HY-N7278
  • NP4491
  • ZINC95562852
  • AKOS040762989
  • DA-75800
  • CS-0112908
  • J1.234.394I
  • [(2R,3S,4S,5R,6S)-6-[[(1R,2S,3R,5R,6R,8S)-2-(benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate
  • ((2R,3S,4S,5R,6S)-6-(((1R,2S,3R,5R,6R,8S)-2-(benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo(4.3.1.02,5.03,8)decan-3-yl)oxy)-3,4,5-trihydroxyoxan-2-yl)methyl 4-hydroxy-3-methoxybenzoate
  • (2R,6abeta)-3abeta-(Benzoyloxymethyl)-4-[6-O-(3-methoxy-4-hydroxybenzoyl)-beta-D-glucopyranosyloxy]-5-methyl-2alpha,5alpha:3alpha,4alpha-dimethanohexahydrofuro[2,3-b]furan-2-ol
  • [(2R,3S,4S,5R,6S)-6-{[(1R,2S,3R,5R,6R,8S)-2-[(benzoyloxy)methyl]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 4-hydroxy-3-methoxybenzoate