(1S,bR)-4-Carboxy-5-[[(1S,4S)-3,3-Dimethyl-2-Oxo-7-Oxabicyclo[2.2.1]Heptan-1-Yl]Methyl]-2,6,7,7a-Tetrahydro-7b-Hydroxy-b,1,7aa-Trimethyl-1H-Indene-1a-Propanoic Acid
[CAS# 83216-10-8]

Identification

• Name: (1S,bR)-4-Carboxy-5-[[(1S,4S)-3,3-Dimethyl-2-Oxo-7-Oxabicyclo[2.2.1]Heptan-1-Yl]Methyl]-2,6,7,7a-Tetrahydro-7b-Hydroxy-b,1,7aa-Trimethyl-1H-Indene-1a-Propanoic Acid
• Synonyms: (1S,7R,7As)-5-[[(1S,4S)-5,5-Dimethyl-7-Oxabicyclo[2.2.1]Heptan-1-Yl]Methyl]-7-Hydroxy-1-[(1R)-3-Hydroxy-1-Methyl-3-Oxo-Propyl]-1,7A-Dimethyl-6,7-Dihydro-2H-Indene-4-Carboxylic Acid; (1S,7R,7As)-5-[[(1S,4S)-5,5-Dimethyl-7-Oxabicyclo[2.2.1]Heptan-1-Yl]Methyl]-7-Hydroxy-1-[(1R)-3-Hydroxy-1-Methyl-3-Oxopropyl]-1,7A-Dimethyl-6,7-Dihydro-2H-Indene-4-Carboxylic Acid; (1S,7R,7As)-5-[[(1S,4S)-5,5-Dimethyl-7-Oxabicyclo[2.2.1]Heptan-1-Yl]Methyl]-7-Hydroxy-1-[(1R)-3-Hydroxy-3-Keto-1-Methyl-Propyl]-1,7A-Dimethyl-6,7-Dihydro-2H-Indene-4-Carboxylic Acid
• Molecular Formula: C₂₅H₃₆O₆
• Molecular Weight: 432.56
• CAS Registry Number: 83216-10-8
• SMILES: [C@@]12([C@@](CC=C1C(=C(C[C@H]2O)C[C@]34O[C@H](C(C3)(C)C)CC4)C(=O)O)([C@@H](CC(=O)O)C)C)C
• InChI: 1S/C25H36O6/c1-14(10-19(27)28)23(4)8-6-16-20(21(29)30)15(11-17(26)24(16,23)5)12-25-9-7-18(31-25)22(2,3)13-25/h6,14,17-18,26H,7-13H2,1-5H3,(H,27,28)(H,29,30)/t14-,17-,18+,23+,24+,25+/m1/s1
• InChIKey: JVZMODMXLQSGPI-MKBZWPJDSA-N