(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione
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![(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/45f1745867594772bd5f403624822023.png "(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione")
(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione
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CAS No:
497-73-4
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Formula:
C25H43NO7
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Chemical Name:
(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione
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Synonyms:
Oxacyclododec-9-ene-2,8-dione,12-[(1R)-1-hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]-,(3R,4S,5S,7R,9E,11R,12S)-;Methymycin,10-deoxy-12-hydroxy-,(12R)-;Neomethymycin;Oxacyclododecane,methymycin deriv.;(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione;11020-46-5
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CAS No:
Description
ChEBI: A twelve-membered macrolide antibiotic that is biosynthesised by Streptomyces venezuelae.
Neomethymycin is a twelve-membered macrolide antibiotic that is biosynthesised by Streptomyces venezuelae. It has a role as a bacterial metabolite. It is an enone, a macrolide antibiotic and a monosaccharide derivative. It is a conjugate base of a neomethymycin(1+).
(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione Basic Attributes
469.619
469.61
2BSX67J222
(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione Use and Manufacturing
Polyketides [PK] -> Macrolides and lactone polyketides [PK04]
Computed Properties
Molecular Weight:469.6
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:469.30395271
Monoisotopic Mass:469.30395271
Topological Polar Surface Area:106
Heavy Atom Count:33
Complexity:696
Defined Atom Stereocenter Count:11
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(3R,4S,5S,7R,9E,11R,12S)-12-[(1R)-1-Hydroxyethyl]-3,5,7,11-tetramethyl-4-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]oxacyclododec-9-ene-2,8-dione
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