11,15-Dihydroxy-16,16-Dimethyl-9-Oxo-(5Z,11A,13E,15R)-Prosta-5,13-Dien-1-Oicacid 4-[[4-(Acetylamino)Benzoyl]Amino]Phenyl Ester
[CAS# 62873-55-6]

Identification

• Name: 11,15-Dihydroxy-16,16-Dimethyl-9-Oxo-(5Z,11A,13E,15R)-Prosta-5,13-Dien-1-Oicacid 4-[[4-(Acetylamino)Benzoyl]Amino]Phenyl Ester
• Synonyms: [4-[(4-Acetamidobenzoyl)Amino]Phenyl] (Z)-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3R)-3-Hydroxy-4,4-Dimethyl-Oct-1-Enyl]-5-Oxo-Cyclopentyl]Hept-5-Enoate; (Z)-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3R)-3-Hydroxy-4,4-Dimethyloct-1-Enyl]-5-Oxocyclopentyl]Hept-5-Enoic Acid [4-[[(4-Acetamidophenyl)-Oxomethyl]Amino]Phenyl] Ester; (Z)-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3R)-3-Hydroxy-4,4-Dimethyl-Oct-1-Enyl]-5-Keto-Cyclopentyl]Hept-5-Enoic Acid [4-[(4-Acetamidobenzoyl)Amino]Phenyl] Ester
• Molecular Formula: C₃₇H₄₈N₂O₇
• Molecular Weight: 632.80
• CAS Registry Number: 62873-55-6
• SMILES: [C@H]1([C@H](C(=O)C[C@H]1O)C\C=C/CCCC(OC3=CC=C(NC(=O)C2=CC=C(NC(=O)C)C=C2)C=C3)=O)\C=C\[C@@H](O)C(CCCC)(C)C
• InChI: 1S/C37H48N2O7/c1-5-6-23-37(3,4)34(43)22-21-31-30(32(41)24-33(31)42)11-9-7-8-10-12-35(44)46-29-19-17-28(18-20-29)39-36(45)26-13-15-27(16-14-26)38-25(2)40/h7,9,13-22,30-31,33-34,42-43H,5-6,8,10-12,23-24H2,1-4H3,(H,38,40)(H,39,45)/b9-7-,22-21+/t30-,31-,33-,34-/m1/s1
• InChIKey: YDCXQLUDGIVYHN-NMEIOLPRSA-N

Properties

• Density: 1.21g/cm³ (Cal.)
• Boiling point: 752.976°C at 760 mmHg (Cal.)
• Flash point: 409.185°C (Cal.)