Sarracine
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Sarracine
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CAS No:
2492-09-3
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Formula:
C18H27NO5
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Chemical Name:
Sarracine
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Synonyms:
2-Butenoic acid,2-(hydroxymethyl)-,[(1S,7R,7aR)-hexahydro-7-[[(2Z)-2-methyl-1-oxo-2-butenyl]oxy]-1H-pyrrolizin-1-yl]methyl ester,(2Z)-;Sarracine;2-Butenoic acid,2-(hydroxymethyl)-,[hexahydro-7-[(2-methyl-1-oxo-2-butenyl)oxy]-1H-pyrrolizin-1-yl]methyl ester,[1S-[1α(Z),7α(Z),7aβ]]-;Sarracin;Platynecine 1-angelate 9-sarracinate
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CAS No:
Drug Information
2-(hydroxymethyl)-hexahydro-7-((2-methyl-1-oxo-2-butenyl)oxy)-1H-pyrrolizin-1-yl-2-butenoic acid
Computed Properties
Molecular Weight:337.4
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:337.18892296
Monoisotopic Mass:337.18892296
Topological Polar Surface Area:76.1
Heavy Atom Count:24
Complexity:540
Undefined Atom Stereocenter Count:3
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes