(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione
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![(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8200c443fd004fa788ce2e304d47a9eb.png "(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione")
(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione
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CAS No:
153445-92-2
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Formula:
C16H22O8
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Chemical Name:
(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione
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Synonyms:
Spiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione,hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methyl-,(1R,3′R,4R,5R,6aR,9R,9aS)-;Spiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione,hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methyl-,[1R-(1α,4β,5β,6β,6aβ,9α,9aβ)]-;(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione;Veranisatin A
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CAS No:
(1R,3′R,4R,5R,6aR,9R,9aS)-Hexahydro-1,5,6a-trihydroxy-5-(methoxymethyl)-9-methylspiro[6H-4,9a-methanocyclopent[d]oxocin-6,3′-oxetane]-2,2′(1H)-dione Basic Attributes
342.34 g/mol
342.34
Computed Properties
Molecular Weight:342.34
XLogP3:-1.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:342.13146766
Monoisotopic Mass:342.13146766
Topological Polar Surface Area:123
Heavy Atom Count:24
Complexity:621
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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