2-丙酮,1-(乙酰氧基)-1-氯-3-羟基-

CAS号
123914-32-9
CCD编号
CCD00117227
分子式
C30 H48 O4
分子量
472.705

基本信息

产品名称: 2-丙酮,1-(乙酰氧基)-1-氯-3-羟基-
CAS: 123914-32-9
中文同义词: 2-丙酮,1-(乙酰氧基)-1-氯-3-羟基-
英文同义词: TRIPTOTRITERPENIC ACID C
MDL号: MFCD00272167
氢键受体数量: 4
氢键供体数量: 3
Smile: C[C@H]1[C@@H](C[C@@H]([C@]2([C@@H]1C3=CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C)O)C(=O)O
InChi: InChI=1S/C30H48O4/c1-17-18(25(33)34)16-23(32)28(5)14-15-29(6)19(24(17)28)8-9-21-27(4)12-11-22(31)26(2,3)20(27)10-13-30(21,29)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)/t17-,18+,20-,21+,22-,23-,24-,27-,28-,29+,30+/m0/s1
InChiKey: InChIKey=IWVWTVWLRSUYNC-YLOASUEESA-N

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