LL-AB 664CAS:29266-98-6
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LL-AB 664CAS:29266-98-6
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CAS No:
29266-98-6
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Formula:
C18H30N8O8
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Chemical Name:
LL-AB 664CAS:29266-98-6
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Synonyms:
Antibiotic LL-AB 664;29266-98-6;LL-AB 664;BD 12;4H-Imidazo(4,5-c)pyridin-4-one, 1,3a,5,6,7,7a-hexahydro-2-((2-deoxy-2-(2-(formimidoylamino)-N-methylacetamido)-beta-D-gulopyranosyl)amino)-7-hydroxy-5-methyl-, 3'-carbamate;DTXSID30951859;[(2R,3R,4S,5R,6R)-6-[[(3aS,7R,7aS)-7-hydroxy-5-methyl-4-oxo-3a,6,7,7a-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl]amino]-5-[[2-(aminomethylideneamino)acetyl]-methylamino]-4-hydroxy-2-(hydroxymethyl)oxan-3-yl] carbamate;J3.598.545J;(3aS)-2-[[4-O-Carbamoyl-2-[methyl[N-(iminomethyl)glycyl]amino]-2-deoxy-beta-D-gulopyranosyl]imino]-2,3,3abeta,4,5,6,7,7aalpha-octahydro-7beta-hydroxy-5-methyl-1H-imidazo[4,5-c]pyridine-4-one;2-Deoxy-4-O-[hydroxy(imino)methyl]-N-(7-hydroxy-5-methyl-4-oxo-3a,4,5,6,7,7a-hexahydro-3H-imidazo[4,5-c]pyridin-2-yl)-2-{[N-(iminomethyl)glycyl](methyl)amino}hexopyranosylamine
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CAS No:
Computed Properties
Molecular Weight:486.5
XLogP3:-5.3
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:486.21865995
Monoisotopic Mass:486.21865995
Topological Polar Surface Area:238
Heavy Atom Count:34
Complexity:856
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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