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Simalikalactone D
[CAS# 35321-80-3]

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CAS#: 35321-80-3
Product: Simalikalactone D
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Identification
Name Simalikalactone D
Synonyms Aids058883; Picras-3-Ene-2,16-Dione, 13,20-Epoxy-1,11,12-Trihydroxy-15-[(2R)-2-Methyl-1-Oxobutoxy]-,[1.Beta.,11.Beta.,12.Alpha.,15.Beta.,]; C08783
Molecular Structure CAS#: 35321-80-3, Simalikalactone D
Molecular Formula C25H34O9
Molecular Weight 478.54
CAS Registry Number 35321-80-3
SMILES [C@]135[C@@H]4[C@]([C@@H](O)[C@@H]([C@@H]1[C@]2([C@@H](C(=O)C=C([C@@H]2C[C@H]3OC(=O)[C@@H]4OC(=O)[C@@H](CC)C)C)O)C)O)(C)OC5
InChI 1S/C25H34O9/c1-6-10(2)21(30)34-16-18-24(5)20(29)15(27)17-23(4)12(11(3)7-13(26)19(23)28)8-14(33-22(16)31)25(17,18)9-32-24/h7,10,12,14-20,27-29H,6,8-9H2,1-5H3/t10-,12+,14-,15-,16-,17-,18+,19-,20+,23+,24+,25-/m1/s1
InChIKey OKIKYYZNNZCZRX-UWGUCYGSSA-N
Properties
Density 1.387g/cm3 (Cal.)
Boiling point 677.675°C at 760 mmHg (Cal.)
Flash point 228.254°C (Cal.)
Market Analysis Reports
List of Reports Available for Simalikalactone D
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