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Crotalaburnine
[CAS# 5096-49-1]

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CAS#: 5096-49-1
Product: Crotalaburnine
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Identification
Name Crotalaburnine
Synonyms Brn 1090468; Nsc 114571; Senecionan-11,16-Dione, 6,12-Dihydroxy-, (6-Beta)-
Molecular Structure CAS#: 5096-49-1, Crotalaburnine
Molecular Formula C18H25NO6
Molecular Weight 351.40
CAS Registry Number 5096-49-1
SMILES [C@H]13OC(C(\C[C@H]([C@](O)(C)C(OCC2=CCN([C@@H]12)C[C@H]3O)=O)C)=C/C)=O
InChI 1S/C18H25NO6/c1-4-11-7-10(2)18(3,23)17(22)24-9-12-5-6-19-8-13(20)15(14(12)19)25-16(11)21/h4-5,10,13-15,20,23H,6-9H2,1-3H3/b11-4-/t10-,13-,14-,15-,18-/m1/s1
InChIKey NPYPUYCITBTPSF-TZCAYXSXSA-N
Properties
Density 1.325g/cm3 (Cal.)
Boiling point 610.336°C at 760 mmHg (Cal.)
Flash point 322.92°C (Cal.)
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List of Reports Available for Crotalaburnine
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