5945-50-6
中文名稱
水晶蘭苷
英文名稱
(1S,2S,6S,9R)-9-hydroxy-9-(hydroxymethyl)-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxabicyclo[4.3.0]nona-4,7-diene-5-carboxylic acid
CAS
5945-50-6
分子式
C16H22O11
分子量
390.34
MOL 文件
5945-50-6.mol
更新日期
2026/05/29 00:08:15
5945-50-6 結(jié)構(gòu)式
基本信息
中文別名
巴戟天0水晶蘭甙
水晶蘭苷
水晶蘭苷(標(biāo)準(zhǔn)品)
水晶蘭苷(水晶蘭甙)
水晶蘭苷 (巴戟天0)
水晶蘭苷, 來(lái)源于水晶蘭
MONOTROPEIN 水晶蘭苷
MONOTROPEIN 水晶蘭苷 標(biāo)準(zhǔn)品
(1S,4AS,7R,7AS)-7-羥基-7-(羥甲基)-1-(((2S,3R,4S,5S,6R)-3,4,5-三羥基-6-(羥甲基)四氫 -2H-吡喃-2-基)氧基)-1,4A,7,7A-四氫環(huán)戊二烯并[C]吡喃-4-羧酸
英文別名
MonotropeinMonotropeine
Morinda officinalis How
Monotropein >=98% (HPLC)
Monotropein, 98%, from Monotropa uniflora L.
1α-(β-D-Glucopyranosyloxy)-1,4aα,7,7aα-tetrahydro-7β-hydroxy-7-(hydroxymethyl)cyclopenta[c]pyran-4-carboxylic acid
Cyclopenta[c]pyran-4-carboxylic acid, 1-(β-D-glucopyranosyloxy)-1,4a,7,7a-tetrahydro-7-hydroxy-7-(hydroxymethyl)-, (1S,4aS,7R,7aS)-
(1S,2S,6S,9R)-9-hydroxy-9-(hydroxymethyl)-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxabicyclo[4.3.0]nona-4,7-diene-5-carboxylic acid
(1S,2S,6S,9R)-9-hydroxy-9-(hydroxymethyl)-2-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxabicyclo[4.3.0]nona-4,7-diene-5-carboxylic acid USP/EP/BP
(1S,4aS,7R,7aS)-7-Hydroxy-7-(hydroxymethyl)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,7,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
所屬類別
生物化工：中草藥成分物理化學(xué)性質(zhì)
外觀性狀白色結(jié)晶粉末，溶于水、甲醇，來(lái)源于鹿銜草、巴戟天。
熔點(diǎn)170-173 °C
沸點(diǎn)717.6±60.0 °C(Predicted)
密度1.73±0.1 g/cm3(Predicted)
儲(chǔ)存條件Sealed in dry,Store in freezer, under -20°C
溶解度Soluble in methanol and water
酸度系數(shù)(pKa)4.31±0.60(Predicted)
形態(tài)粉末
顏色白色
主要應(yīng)用metabolomics
vitamins, nutraceuticals, and natural products
vitamins, nutraceuticals, and natural products
InChI1S/C16H22O10/c17-3-7-5-24-14(10-8(7)1-2-16(10,23)6-19)26-15-13(22)12(21)11(20)9(4-18)25-15/h1-3,5,8-15,18-23H,4,6H2/t8-,9-,10-,11-,12+,13-,14+,15+,16+/m1/s1
InChIKeyCYYIGLDAAXXQAI-PSWNKMJPSA-N
SMILESO[C@H]1[C@H](O)[C@@H](O)[C@@](O[C@H]2[C@@]([C@](CO)(O)C=C3)([H])[C@@]3([H])C(C(O)=O)=CO2)([H])O[C@@H]1CO
安全數(shù)據(jù)
警示詞警告
危險(xiǎn)性描述H302-H315-H319-H335
安全說(shuō)明24/25
WGK GermanyWGK 3
海關(guān)編碼29389090
存儲(chǔ)類別11 - Combustible Solids
危險(xiǎn)性類別Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3