Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, [2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl] ester, [1R-[1α(2R*,3R*),7aβ]]-
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Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, [2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl] ester, [1R-[1α(2R*,3R*),7aβ]]-
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CAS No:
6224-43-7
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Formula:
C15H25NO5
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Chemical Name:
Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, [2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl] ester, [1R-[1α(2R*,3R*),7aβ]]-
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Synonyms:
Butanoic acid,2,3-dihydroxy-2-(1-methylethyl)-,[2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl] ester,[1R-[1α(2R*,3R*),7aβ]]-;Retronecine,7-(2,3-dihydroxy-2-isopropylbutyrate);Isolycopsamine;1,2-Dehydro-1-hydroxymethyl-7β-(+)-viridifloroxy-8α-pyrrolizidine;iso-Lycopsamine;Retronecine 1-((+)-viridiflorate)
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CAS No:
Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, [2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-yl] ester, [1R-[1α(2R*,3R*),7aβ]]- Basic Attributes
299.36 g/mol
299.36
DTXSID50331932
Computed Properties
Molecular Weight:299.36
XLogP3:-0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:299.17327290
Monoisotopic Mass:299.17327290
Topological Polar Surface Area:90.2
Heavy Atom Count:21
Complexity:436
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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