Methyl (1S,4aR,4bS,8R,8aS,9S,10aR)-9-hydroxy-7-[2-(2-hydroxyethyl-methylamino)-2-oxoethylidene]-1,4a,8-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate
[CAS# 40445-00-9]

Identification

• Name: Methyl (1S,4aR,4bS,8R,8aS,9S,10aR)-9-hydroxy-7-[2-(2-hydroxyethyl-methylamino)-2-oxoethylidene]-1,4a,8-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate
• Synonyms: Methyl (1S,4Ar,4Bs,8R,8As,9S,10Ar)-9-Hydroxy-7-[2-(2-Hydroxyethyl-Methyl-Amino)-2-Oxo-Ethylidene]-1,4A,8-Trimethyl-3,4,4B,5,6,8,8A,9,10,10A-Decahydro-2H-Phenanthrene-1-Carboxylate; (1S,4Ar,4Bs,8R,8As,9S,10Ar)-9-Hydroxy-7-[2-(2-Hydroxyethyl-Methylamino)-2-Oxoethylidene]-1,4A,8-Trimethyl-3,4,4B,5,6,8,8A,9,10,10A-Decahydro-2H-Phenanthrene-1-Carboxylic Acid Methyl Ester; (1S,4Ar,4Bs,8R,8As,9S,10Ar)-9-Hydroxy-7-[2-(2-Hydroxyethyl-Methyl-Amino)-2-Keto-Ethylidene]-1,4A,8-Trimethyl-3,4,4B,5,6,8,8A,9,10,10A-Decahydro-2H-Phenanthrene-1-Carboxylic Acid Methyl Ester
• Molecular Formula: C₂₄H₃₉NO₅
• Molecular Weight: 421.58
• CAS Registry Number: 40445-00-9
• SMILES: [C@]12([C@H]([C@](C(=O)OC)(C)CCC1)C[C@@H]([C@@H]3[C@@H]2CCC(=C/C(N(CCO)C)=O)\[C@@H]3C)O)C
• InChI: 1S/C24H39NO5/c1-15-16(13-20(28)25(4)11-12-26)7-8-17-21(15)18(27)14-19-23(17,2)9-6-10-24(19,3)22(29)30-5/h13,15,17-19,21,26-27H,6-12,14H2,1-5H3/b16-13+/t15-,17-,18-,19+,21-,23+,24-/m0/s1
• InChIKey: WWNAKNLFTIEHKX-ZEJGPHSTSA-N