474-25-9 Purity
98%
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Specification
The PubChem CID of rimexolone is 5311412.
The molecular formula of rimexolone is C24H34O3.
The molecular weight of rimexolone is 370.5 g/mol.
The IUPAC name of rimexolone is (8S,9S,10R,11S,13S,14S,16R,17S)-11-hydroxy-10,13,16,17-tetramethyl-17-propanoyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one.
The InChI of rimexolone is InChI=1S/C24H34O3/c1-6-20(27)24(5)14(2)11-18-17-8-7-15-12-16(25)9-10-22(15,3)21(17)19(26)13-23(18,24)4/h9-10,12,14,17-19,21,26H,6-8,11,13H2,1-5H3/t14-,17+,18+,19+,21-,22+,23+,24-/m1/s1.
The InChIKey of rimexolone is QTTRZHGPGKRAFB-OOKHYKNYSA-N.
The canonical SMILES of rimexolone is CCC(=O)C1(C(CC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)C)C.
The CAS number of rimexolone is 49697-38-3.
The XLogP3 value of rimexolone is 3.5.
The topological polar surface area of rimexolone is 54.4Ų.