主记录
C52H60O9
- CAS
- 956966-83-9
- PubChem CID
- 16402418
- SMILES
- C[C@@H]1CCC2[C@@]([C@@]13CC[C@](O3)(CCOC(=O)C4=CC=CC=C4C)COC(=O)C5=CC=CC=C5C)(CC[C@@H]([C@@]2(C)COC(=O)C6=CC=CC=C6C)OC(=O)C7=CC=CC=C7C)C
- 分子式
- C52H60O9
- 分子量
- 829.043
- 精确分子量
- 828.4237
- InChI
- InChI=1S/C52H60O9/c1-34-16-8-12-20-39(34)45(53)57-31-30-51(33-59-47(55)41-22-14-10-18-36(41)3)28-29-52(61-51)38(5)24-25-43-49(6,32-58-46(54)40-21-13-9-17-35(40)2)44(26-27-50(43,52)7)60-48(56)42-23-15-11-19-37(42)4/h8-23,38,43-44H,24-33H2,1-7H3/t38-,43?,44+,49+,50+,51+,52-/m1/s1
- InChIKey
- OCBCWMPNUOYPRF-IRAXYNMDSA-N
- LogP
- 10.5473
- TPSA
- 114.43
名称与别名
- C52H60O9
- AKOS032429168
- ((1'R,2'R,5S,5'R,6'S,8a'S)-2',5',8a'-trimethyl-6'-((2-methylbenzoyl)oxy)-5-(2-((2-methylbenzoyl)oxy)ethyl)decahydro-2'H,3H-spiro[furan-2,1'-naphthalene]-5,5'-diyl)bis(methylene) bis(2-methylbenzoate)
- 956966-83-9