Bistratene A
[CAS# 115566-02-4]

Identification

• Name: Bistratene A
• Synonyms: 3-Hydroxy-N-[3-[8-[(E)-6-Hydroxy-3,5-Dimethyl-Hept-4-Enyl]-3-Methyl-1,7-Dioxaspiro[5.5]Undecan-2-Yl]Propyl]-2-Methyl-4-[[2-[3-Methyl-6-[(Z)-2-Oxopent-3-Enyl]Tetrahydropyran-2-Yl]Acetyl]Amino]Butanamide; 3-Hydroxy-N-[3-[8-[(E)-6-Hydroxy-3,5-Dimethylhept-4-Enyl]-3-Methyl-1,7-Dioxaspiro[5.5]Undecan-2-Yl]Propyl]-2-Methyl-4-[[2-[3-Methyl-6-[(Z)-2-Oxopent-3-Enyl]-2-Tetrahydropyranyl]-1-Oxoethyl]Amino]Butanamide; 3-Hydroxy-N-[3-[8-[(E)-6-Hydroxy-3,5-Dimethyl-Hept-4-Enyl]-3-Methyl-1,7-Dioxaspiro[5.5]Undecan-2-Yl]Propyl]-4-[[2-[6-[(Z)-2-Ketopent-3-Enyl]-3-Methyl-Tetrahydropyran-2-Yl]Acetyl]Amino]-2-Methyl-Butyramide
• Molecular Formula: C₄₀H₆₈N₂O₈
• Molecular Weight: 704.99
• CAS Registry Number: 115566-02-4
• SMILES: C(C2OC1(OC(CCC1)CCC(\C=C(C(O)C)/C)C)CCC2C)CCNC(=O)C(C(O)CNC(=O)CC3OC(CCC3C)CC(=O)\C=C/C)C
• InChI: 1S/C40H68N2O8/c1-8-11-32(44)23-34-17-15-27(3)37(48-34)24-38(46)42-25-35(45)30(6)39(47)41-21-10-13-36-28(4)18-20-40(50-36)19-9-12-33(49-40)16-14-26(2)22-29(5)31(7)43/h8,11,22,26-28,30-31,33-37,43,45H,9-10,12-21,23-25H2,1-7H3,(H,41,47)(H,42,46)/b11-8-,29-22+
• InChIKey: HXZRMADPDYFMEB-MLTUFRGDSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 875.694°C at 760 mmHg (Cal.)
• Flash point: 483.403°C (Cal.)