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59654-07-8 | (6S,7R)-3',4',6,8-Tetrahydro-6',7'-dimethoxy-2'-methylspiro[7H-indeno[4,5-d]-1,3-dioxole-7,1'(2'H)-isoquinoline]-6α,8α-diol
CAS No: 59654-07-8 Catalog No: AG00F2A6 MDL No:
Product Description
Catalog Number:
AG00F2A6
Chemical Name:
(6S,7R)-3',4',6,8-Tetrahydro-6',7'-dimethoxy-2'-methylspiro[7H-indeno[4,5-d]-1,3-dioxole-7,1'(2'H)-isoquinoline]-6α,8α-diol
CAS Number:
59654-07-8
IUPAC Name:
6,7-dimethoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-6,8-dihydrocyclopenta[g][1,3]benzodioxole]-6',8'-diol
InChI:
InChI=1S/C21H23NO6/c1-22-7-6-11-8-15(25-2)16(26-3)9-13(11)21(22)19(23)12-4-5-14-18(28-10-27-14)17(12)20(21)24/h4-5,8-9,19-20,23-24H,6-7,10H2,1-3H3
InChI Key:
GBRMPBIZRSWCMZ-UHFFFAOYSA-N
Properties
Complexity:
591
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.153g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
385.416g/mol
Monoisotopic Mass:
385.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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