Didrovaltrate
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Didrovaltrate
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CAS No:
18296-45-2
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Formula:
C22H32O8
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Chemical Name:
Didrovaltrate
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Synonyms:
Butanoic acid,3-methyl-,(1S,2′R,4aS,6S,7aS)-6-(acetyloxy)-4a,5,6,7a-tetrahydro-4-[(3-methyl-1-oxobutoxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2′-oxiran]-1-yl ester;Butanoic acid,3-methyl-,6-(acetyloxy)-4a,5,6,7a-tetrahydro-4-[(3-methyl-1-oxobutoxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2′-oxiran]-1-yl ester,[1S-(1α,4aα,6α,7β,7aα)]-;Spiro[cyclopenta[c]pyran-7(1H),2′-oxirane],butanoic acid deriv.;Didrovaltratum;Dihydroisovalepotriate;Dihydroisovaltrate;Didrovaltrate;Dihydroisovaltratum;NSC 335756;16088-53-2;31078-11-2
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CAS No:
Didrovaltrate Use and Manufacturing
Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Computed Properties
Molecular Weight:424.5
XLogP3:2.3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:11
Exact Mass:424.20971797
Monoisotopic Mass:424.20971797
Topological Polar Surface Area:101
Heavy Atom Count:30
Complexity:712
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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