 Home > Encyclopedia > 2-Butenoic acid, 3-methyl-, (3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester

2-Butenoic acid, 3-methyl-, (3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester

2-Butenoic acid, 3-methyl-, (3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester structure

CAS No:
6995-12-6
Formula:
C20H24O6
Chemical Name:
2-Butenoic acid, 3-methyl-, (3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester
Synonyms:
2-Butenoic acid,3-methyl-,(3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester;2-Butenoic acid,3-methyl-,2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester,[3aS-(3aα,4α,4aβ,7aα,8α,9β,9aα)]-;Ambrosa-2,11(13)-dien-12-oic acid,6α,8β,9β-trihydroxy-4-oxo-,12,8-lactone,6-(3-methylcrotonate);Crotonic acid,3-methyl-,4-ester with 3,3a,4,4a,7aα,8,9,9a-octahydro-4α,9-dihydroxy-4aβ,8α-dimethyl-3-methyleneazuleno[6,5-b]furan-2,5-dione;Fastigilin C;NSC 176507;NSC 94036;31190-16-6;33124-81-1

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2-Butenoic acid, 3-methyl-, (3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester Basic Attributes

Molecular Weight：

360.4 g/mol

Exact Mass：

360.40

NSC Number：

176507|94036

Characteristics

PSA：

89.9 Å²

Melting Point：

197-199 °C

Computed Properties

Molecular Weight:360.4
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:360.15728848
Monoisotopic Mass:360.15728848
Topological Polar Surface Area:89.9
Heavy Atom Count:26
Complexity:743
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Butenoic acid, 3-methyl-, (3aS,4S,4aR,7aS,8S,9R,9aS)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-9-hydroxy-4a,8-dimethyl-3-methylene-2,5-dioxoazuleno[6,5-b]furan-4-yl ester

Basic Attributes
Characteristics
Computed Properties
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