81425-29-8 (zizyvosideII,zizyvosideII)

CAS号:
81425-29-8
中文名称:
zizyvosideII
英文名称:
zizyvosideII
分子式:
C31H50O18
分子量:
710.717912197113

zizyvosideII(81425-29-8)名称与标识符

名称

英文别名:
zizyvosideII;2-Cyclohexen-1-one, 4-[(1E,3R)-3-[(O-β-D-glucopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-β-D-glucopyranosyl)oxy]-1-buten-1-yl]-4-hydroxy-3,5,5-trimethyl-, (4S)-;

标识符

InChIKey:
MNDOMGYJMYEKQR-UHFFFAOYSA-N
Inchi:
1S/C31H50O18/c1-12-7-14(35)8-30(3,4)31(12,43)6-5-13(2)44-29-26(49-28-24(42)22(40)19(37)16(10-33)46-28)25(20(38)17(11-34)47-29)48-27-23(41)21(39)18(36)15(9-32)45-27/h5-7,13,15-29,32-34,36-43H,8-11H2,1-4H3
SMILES:
CC(C=CC1(C(C)(C)CC(=O)C=C1C)O)OC1C(OC2C(O)C(O)C(O)C(CO)O2)C(OC2C(O)C(O)C(O)C(CO)O2)C(O)C(CO)O1

zizyvosideII(81425-29-8)物化性质

实验特性

  • 沸点 : 956.6±65.0 °C(Predicted)
  • 酸度系数(pKa) : 12.46±0.60(Predicted)
  • 密度 : 1.54±0.1 g/cm3(Predicted)