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478-38-6 | (3S)-2,3,4,10-Tetrahydro-3-hydroxy-9-methoxy-2,2,10-trimethyl-5H-pyrano[2,3-b]quinolin-5-one
CAS No: 478-38-6 Catalog No: AG00DZD6 MDL No:
Product Description
Catalog Number:
AG00DZD6
Chemical Name:
(3S)-2,3,4,10-Tetrahydro-3-hydroxy-9-methoxy-2,2,10-trimethyl-5H-pyrano[2,3-b]quinolin-5-one
CAS Number:
478-38-6
IUPAC Name:
(3S)-3-hydroxy-9-methoxy-2,2,10-trimethyl-3,4-dihydropyrano[2,3-b]quinolin-5-one
InChI:
InChI=1S/C16H19NO4/c1-16(2)12(18)8-10-14(19)9-6-5-7-11(20-4)13(9)17(3)15(10)21-16/h5-7,12,18H,8H2,1-4H3/t12-/m0/s1
InChI Key:
MSDAMDHEPWLWJZ-LBPRGKRZSA-N
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
289.131g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.331g/mol
Monoisotopic Mass:
289.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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