英文别名 | (4aR,4bS,6aS,7S,9aS,9bS)-3-(~13~C_2_)Ethanoyl-4a,6a-dimethyl-2-oxo-2,3,4,4a,4b,5,6,6a,7,8,9,9a,9b,10-tetradecahydroindeno[5,4-f]chromen-7-ylbenzoate: |
CAS号 | 82938-00-9 |
SMILES | [13CH3][13C](=O)C1C[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4OC(=O)C5=CC=CC=C5)[C@@H]3CC=C2OC1=O
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC(=O)c4ccccc4)CC=C5[C@@]3(CC(C(=O)O5)[13C](=O)[13CH3])C |
Inchi | InChI=1S/C27H32O5/c1-16(28)19-15-27(3)21-13-14-26(2)20(18(21)9-11-23(27)32-25(19)30)10-12-22(26)31-24(29)17-7-5-4-6-8-17/h4-8,11,18-22H,9-10,12-15H2,1-3H3/t18-,19?,20-,21-,22-,26-,27+/m0/s1/i1+1,16+1 |
InchiKey | RNQBMXCMFMAZMY-NNFJFETISA-N |
分子式 Formula | C2513C2H32O5 |
分子量 Molecular Weight | 439 |
Polarizability极化度 | 47.3±0.5 10-24cm3 |
密度 Density | 1.2±0.1 g/cm3 |
储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |