(E)-2-(Hydroxymethyl)-2-butenoic acid (3aR)-2,3,3aβ,4,5,5a,6,7,8,9,9aβ,9bα-dodecahydro-6α-hydroxy-5aα-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4α-yl ester
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(E)-2-(Hydroxymethyl)-2-butenoic acid (3aR)-2,3,3aβ,4,5,5a,6,7,8,9,9aβ,9bα-dodecahydro-6α-hydroxy-5aα-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4α-yl ester
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CAS No:
94190-28-0
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Formula:
C20H26O6
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Chemical Name:
(E)-2-(Hydroxymethyl)-2-butenoic acid (3aR)-2,3,3aβ,4,5,5a,6,7,8,9,9aβ,9bα-dodecahydro-6α-hydroxy-5aα-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4α-yl ester
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Synonyms:
Trichomatolide E
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CAS No:
(E)-2-(Hydroxymethyl)-2-butenoic acid (3aR)-2,3,3aβ,4,5,5a,6,7,8,9,9aβ,9bα-dodecahydro-6α-hydroxy-5aα-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4α-yl ester Basic Attributes
362.41684
362.173
Computed Properties
Molecular Weight:362.4
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:362.17293854
Monoisotopic Mass:362.17293854
Topological Polar Surface Area:93.1
Heavy Atom Count:26
Complexity:692
Defined Atom Stereocenter Count:6
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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