CAS: 61617-29-6; 2,2,6A,6B,9,9,12A-Heptamethyl-10-((3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Oxy)-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylic Acid

英文名称2,2,6A,6B,9,9,12A-Heptamethyl-10-((3,4,5-Trihydroxytetrahydro-2H-Pyran-2-yl)Oxy)-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylic Acid
中文名称齐墩果酸-3-O-β-D-氧基吡喃木糖苷
IUPAC名称2,2,6a,6b,9,9,12a-heptamethyl-10-((3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
其它别名Oleanolic Acid-3-O-Beta-D-Xylopyranoside; Songoroside A; Olean-12-En-28-Oic Acid, 3-(β-D-Xylopyranosyloxy)-, (3β)-; Oleanolic Acid -3-O-Beta-D-Oxyxylopyranoside
CAS编号61617-29-6
分子式:C35H56O7分子量:588.83
产品CID: 1598222
产品分类天然产物 → 萜类

相似结构搜索
产品信息参考
InChIKey: HZLWUYJLOIAQFC-UHFFFAOYSA-N
InChI=1S/C35H56O7/c1-30(2)14-16-35(29(39)40)17-15-33(6)20(21(35)18-30)8-9-24-32(5)12-11-25(31(3,4)23(32)10-13-34(24,33)7)42-28-27(38)26(37)22(36)19-41-28/h8,21-28,36-38H,
计算化学: 氢键受体数7.0氢键供体数4.0可旋转键数3.0

物理性质

熔点238-239 °C
沸点685.4±55.0 °C at 760 mmHg
闪点208.1±25.0 °C
密度1.2±0.1 g/cm3
pKa:4?+-.0.70(预测)
PSA:116.45
LogP:9.34
折射率1.579
蒸汽压0.0±4.8 mmHg at 25°C
溶解性Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
外观形态粉末
储存条件室温

MSDS等安全信息

危险描述H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
防范说明P264+P280+P305+P351+P338+P337+P313
危险品标志Xi
安全声明H303+H313+H333

上下游产品

oleanolic acid 3-O-β-D-xylopyranosyl-(1-3)-α-L-rhamnopyranosyl-(1-2)-α-L-arabinopyranoside oleanolic acid 3-O-β-D-glucopyranosyl-(1-4)-β-D-xylopyranosyl-(1-3)-α-L-rhamnopyranosyl-(1-2)-α-L-arabinopyranoside oleanolic acid 3-O-β-D-glucopyranosyl-(1-4)-β-D-glucopyranosyl-(1-4)-β-D-xylopyranosyl-(1-3)-α-L-rhamnopyranosyl-(1-2)-α-L-arabinopyranoside oleanolic acid 3-O-β-D-ribopyranosyl-(1-3)-α-L-rhamnopyranosyl-(1-2)-α-L-arabinopyranosideL-arabinose Oleanolic acid