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41547-66-4 | (3R)-3,4,5,6-Tetrahydro-4α,5α-dihydroxy-9-methyl-3β,6β-epoxy-2H,8H-pyrimido[6,1-b][1,3]oxazocine-8,10(9H)-dione
CAS No: 41547-66-4 Catalog No: AG00D6VG MDL No:
Product Description
Catalog Number:
AG00D6VG
Chemical Name:
(3R)-3,4,5,6-Tetrahydro-4α,5α-dihydroxy-9-methyl-3β,6β-epoxy-2H,8H-pyrimido[6,1-b][1,3]oxazocine-8,10(9H)-dione
CAS Number:
41547-66-4
IUPAC Name:
(1R,10R,11R,12S)-11,12-dihydroxy-4-methyl-8,13-dioxa-2,4-diazatricyclo[8.2.1.02,7]tridec-6-ene-3,5-dione
InChI:
InChI=1S/C10H12N2O6/c1-11-5(13)2-6-12(10(11)16)9-8(15)7(14)4(18-9)3-17-6/h2,4,7-9,14-15H,3H2,1H3/t4-,7+,8+,9-/m1/s1
InChI Key:
YYGJMPXDSZVSCH-CYAXSCHPSA-N
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
256.07g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.214g/mol
Monoisotopic Mass:
256.07g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
99.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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