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15330-63-9 | (5,9,10-trimethoxy-2,2-dimethyl-12-oxo-3,4-dihydro-2h,12h-pyrano[2,3-a]xanthen-11-yl)acetaldehyde
CAS No: 15330-63-9 Catalog No: AG007IH7 MDL No:
Product Description
Catalog Number:
AG007IH7
Chemical Name:
(5,9,10-trimethoxy-2,2-dimethyl-12-oxo-3,4-dihydro-2h,12h-pyrano[2,3-a]xanthen-11-yl)acetaldehyde
CAS Number:
15330-63-9
Molecular Formula:
C23H24O7
Molecular Weight:
412.4325
IUPAC Name:
2-(5,9,10-trimethoxy-2,2-dimethyl-12-oxo-3,4-dihydropyrano[2,3-a]xanthen-11-yl)acetaldehyde
InChI:
InChI=1S/C23H24O7/c1-23(2)8-6-12-14(26-3)10-16-19(22(12)30-23)20(25)18-13(7-9-24)21(28-5)17(27-4)11-15(18)29-16/h9-11H,6-8H2,1-5H3
InChI Key:
OUDLYLYPVPSTNN-UHFFFAOYSA-N
SMILES:
O=CCc1c(OC)c(OC)cc2c1c(=O)c1c(o2)cc(c2c1OC(C)(C)CC2)OC
NSC Number:
139167
Properties
Complexity:
650
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.152g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
412.438g/mol
Monoisotopic Mass:
412.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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