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Home Other Building Blocks Benz[a]anthracene-1,7,12(2H)-trione, 3,4-dihydro-8-hydroxy-3-methyl-, (3S)-

Benz[a]anthracene-1,7,12(2H)-trione, 3,4-dihydro-8-hydroxy-3-methyl-, (3S)-

CAS No.:
28882-53-3
Catalog Number:
AG002WXR
Molecular Formula:
C19H14O4
Molecular Weight:
306.3121
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$290
- +
5mg
≥95%
1 week
United States
$1089
- +
Product Description
Catalog Number:
AG002WXR
Chemical Name:
Benz[a]anthracene-1,7,12(2H)-trione, 3,4-dihydro-8-hydroxy-3-methyl-, (3S)-
CAS Number:
28882-53-3
Molecular Formula:
C19H14O4
Molecular Weight:
306.3121
MDL Number:
MFCD09802288
IUPAC Name:
(3S)-8-hydroxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione
InChI:
InChI=1S/C19H14O4/c1-9-7-10-5-6-12-17(15(10)14(21)8-9)19(23)11-3-2-4-13(20)16(11)18(12)22/h2-6,9,20H,7-8H2,1H3/t9-/m0/s1
InChI Key:
ZAWXOCUFQSQDJS-VIFPVBQESA-N
SMILES:
C[C@@H]1CC(=O)c2c(C1)ccc1c2C(=O)c2c(C1=O)c(O)ccc2
UNII:
CKZ6P7I25M
Properties
Complexity:
554  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
306.089g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
306.317g/mol
Monoisotopic Mass:
306.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Literature
Title Journal
Saccharosporones A, B and C, cytotoxic antimalarial angucyclinones from Saccharopolyspora sp. BCC 21906. The Journal of antibiotics 20130601
Angucyclinone antibiotics: total syntheses of YM-181741, (+)-ochromycinone, (+)-rubiginone B2, (-)-tetrangomycin, and MM-47755. The Journal of organic chemistry 20070803
Efficient method for synthesis of angucyclinone antibiotics via gold-catalyzed intramolecular [4 + 2] benzannulation: enantioselective total synthesis of (+)-ochromycinone and (+)-rubiginone B2. The Journal of organic chemistry 20051028
Properties