Oleanolic acid[1]
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IUPAC名 (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
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系統IUPAC名 (1R,2S,5S,10S,14R,15R,18S,20R)-18-hydroxy-1,2,8,8,15,19,19-heptamethylpentacyc lo[12.8.0.02,11.05,10.015,20]docos-11-ene-5-carboxylic acid (1R,2S,5S,10S,14R,15R,18S,20R)-1,2,8,8,15,19,19-七甲基-18-羥基五環[12.8.0.02,11.05,10.015,20]-11-二十二烯-5-甲酸
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別名
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Oleanic acid
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識別
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CAS號
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508-02-1 Y
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PubChem
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10494
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ChemSpider
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10062
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SMILES
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- O=C(O)[C@@]54[C@H](/C3=C/C[C@H]1[C@](CC[C@@H]2[C@]1(C)CC[C@H](O)C2(C)C)(C)[C@]3(C)CC4)CC(C)(C)CC5
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InChI
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- 1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,27-,28+,29+,30-/m0/s1
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InChIKey
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MIJYXULNPSFWEK-GTOFXWBIBS
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EINECS
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208-081-6
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ChEBI
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37659
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IUPHAR配體
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3306
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性質
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化學式
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C30H48O3
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摩爾質量
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456.7 g·mol−1
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外觀
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White
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熔點
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300 °C(573 K)
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若非註明,所有數據均出自標準狀態(25 ℃,100 kPa)下。
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