栎樱酸

pro_cas
6812-81-3
pro_cdbregno
CCD00898609
pro_formula
C30 H48 O2
pro_molWeight
440.707

basic_info

Product_Name: 栎樱酸
CAS: 6812-81-3
中文同义词: 栎樱酸
EnglishSynonyms: ROBURIC ACID ; 3-[(1S,2S,4AR,4BS,6AR,9R,10S,10AR,12AR)-2-ISOPROPENYL-1,4A,4B,6A,9,10-HEXAMETHYL-2,3,4,5,6,7,8,9,10,10A,12,12A-DODECAHYDROCHRYSEN-1-
pro_mdlNumber: MFCD09953817
pro_acceptors: 2
pro_donors: 1
pro_smile: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@H]([C@]4(C)CCC(=O)O)C(=C)C)C)[C@@H]2[C@H]1C)C)C
InChi: InChI=1S/C30H48O2/c1-19(2)22-12-16-30(8)24(28(22,6)15-13-25(31)32)10-9-23-26-21(4)20(3)11-14-27(26,5)17-18-29(23,30)7/h9,20-22,24,26H,1,10-18H2,2-8H3,(H,31,32)/t20-,21+,22+,24-,26+,27-,28+,29-,30-/m1/s1
InChiKey: InChIKey=RPPYCVULPFKBOG-CSHKLQQTSA-N

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