4-Epitetracycline ammmonium salt, min.98% (HPLC)

Name: 4-Epitetracycline ammmonium salt
Brand: Chempure

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CAS Number

16505-45-6

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IUPAC name	azanium;(4R,4aS,5aS,6S,12aR)-2-carbamoyl-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracen-1-olate
inchi	InChI=1S/C22H24N2O8.H3N/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28;/h4-6,9-10,15,25-26,29,31-32H,7H2,1-3H3,(H2,23,30);1H3/t9-,10-,15+,21+,22-;/m0./s1
inchi key	VSPSYUWNYBVIPQ-DXDJYCPMSA-N
molecular formula	C22H27N3O8
synonyms	Epitetracycline ammonium salt 16505-45-6 Ammonium quatrimycin azanium;(4R,4aS,5aS,6S,12aR)-2-carbamoyl-4-(dimethylamino)-6,10,11,12a-tetrahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracen-1-olate 4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide monoammonium salt, (4R-(4alpha,4abeta,5abeta,6alpha,12abeta))-

Computed Properties

Molecular Weight:	461.5 g/mol
Hydrogen Bond Donor Count:	6
Hydrogen Bond Acceptor Count:	9
Rotatable Bond Count:	2
Exact Mass:	461.17981483 Da
Monoisotopic Mass:	461.17981483 Da
Topological Polar Surface Area:	185 Å²
Heavy Atom Count:	33
Formal Charge:	0
Complexity:	971
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	5
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	2
Compound Is Canonicalized:	Yes

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Product No: DT8408

4-Epitetracycline ammmonium salt, min.98% (HPLC)

Product No: DT8408

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