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齐墩果酸溴乙酯
2-Bromoethyl oleanolate
(3beta)-3-Hydroxy-olean-12-en-28-oic acid 2-bromoethyl ester, 2-Bromoethyl (3beta)-3-hydroxyolean-12-en-28-oate
CAS号: 875753-08-5
IUPAC名称: 2-bromoethyl (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-carboxylate
分子式: C32H51BrO3
分子量: 563.65000
InChI: InChI=1S/C32H51BrO3/c1-27(2)14-16-32(26(35)36-19-18-33)17-15-30(6)21(22(32)20-27)8-9-24-29(5)12-11-25(34)28(3,4)23(29)10-13-31(24,30)7/h8,22-25,34H,9-20H2,1-7H3/t22-,23-,24+,25-,29-,30+,31+,32-/m0/s1
InChIKey: AWEKTNNNXSTPIC-DFHVBEEKSA-N
SMILES: C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)OCCBr)C)C)(C)C)O
EINECS: -
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