(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one
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![(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e988d11457da4675988f1eb32175ab01.png "(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one")
(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one
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CAS No:
70449-72-8
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Formula:
C25H28O8
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Chemical Name:
(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one
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Synonyms:
Tricoccin S14;(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one
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CAS No:
(1aS,6bR)-1aα,2,3,6b-Tetrahydro-4α-(3-furyl)-6b-[3-[(3S,3aR,6aR)-hexahydro-2,2,3a-trimethyl-5-oxofuro[3,2-b]furan-3-yl]-2-oxopropyl]-3aα,6aα-methanooxireno[e]isobenzofuran-6(4H)-one Basic Attributes
456.48502
456.178
Computed Properties
Molecular Weight:456.5
XLogP3:0.6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:456.17841785
Monoisotopic Mass:456.17841785
Topological Polar Surface Area:105
Heavy Atom Count:33
Complexity:976
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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