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1235126-46-1

1235126-46-1 | Dispiro[4.3.4.3]hexadeca-2,6,11,14-tetraene-1,4,10,13-tetrone, 2,3,6,11,12,14-hexamethoxy-8,16-diphenyl-, (8R,16R)-rel-

CAS No: 1235126-46-1 Catalog No: AG000KPX MDL No:MFCD20260388

Product Description

Catalog Number:
AG000KPX
Chemical Name:
Dispiro[4.3.4.3]hexadeca-2,6,11,14-tetraene-1,4,10,13-tetrone, 2,3,6,11,12,14-hexamethoxy-8,16-diphenyl-, (8R,16R)-rel-
CAS Number:
1235126-46-1
Molecular Formula:
C34H32O10
Molecular Weight:
600.6119
MDL Number:
MFCD20260388
IUPAC Name:
(6R,7E,14R,15E)-2,3,8,11,12,16-hexamethoxy-6,14-diphenyldispiro[4.3.49.35]hexadeca-2,7,11,15-tetraene-1,4,10,13-tetrone
InChI:
InChI=1S/C34H32O10/c1-39-23-17-21(19-13-9-7-10-14-19)34(31(37)27(43-5)28(44-6)32(34)38)24(40-2)18-22(20-15-11-8-12-16-20)33(23)29(35)25(41-3)26(42-4)30(33)36/h7-18,21-22H,1-6H3/b23-17+,24-18+/t21-,22-/m1/s1
InChI Key:
OASRMBZSJNAYKB-PEFZSZSLSA-N
SMILES:
COC1=C[C@H](c2ccccc2)C2(C(=C[C@@H](C31C(=O)C(=C(C3=O)OC)OC)c1ccccc1)OC)C(=O)C(=C(C2=O)OC)OC

Properties

Complexity:
1180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
2  
Exact Mass:
600.2g/mol
Formal Charge:
0
Heavy Atom Count:
44  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
600.62g/mol
Monoisotopic Mass:
600.2g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

Literature

Title Journal
Biomimetic total syntheses of linderaspirone A and bi-linderone and revisions of their biosynthetic pathways. Organic letters 20110506
A pair of windmill-shaped enantiomers from Lindera aggregata with activity toward improvement of insulin sensitivity. Organic letters 20100716

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