CAS: 478-43-3
الاسم: 4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid
SMILES:
C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)OMolecular Processing
Molecular formula
C15H8O6
Molecular weight
284.22
Exact mass
284.0321
XLogP
1.57
TPSA
111.9
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
70.04
Supplementary Information
InChIKey: FCDLCPWAQCPTKC-UHFFFAOYSA-N
مرادفات
Rhein478-43-3MonorheinCassic acidRhubarb YellowRheic acid4,5-Dihydroxyanthraquinone-2-carboxylic acidChrysazin-3-carboxylic acid1,8-Dihydroxyanthraquinone-3-carboxylic acid4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid9,10-Dihydro-4,5-dihydroxy-9,10-dioxo-2-anthracenecarboxylic acidDTXSID4026000YM64C2P6UX2-Anthroic acid, 9,10-dihydro-4,5-dihydroxy-9,10-dioxo-NSC-38629DTXCID6060001,8-dihydroxy-3-carboxyl-9,10-anthraquinoneRefChem:882948207-521-41,8-Dihydroxy-3-carboxyanthraquinone4,5-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acidNSC 38629MFCD00009618C15H8O6Rhein (Standard)2-Anthracenecarboxylic acid, 9,10-dihydro-4,5-dihydroxy-9,10-dioxo-4,5-Dihydroxy-2-anthraquinonecarboxylic acidMLS0000696394,5-DiOH-anthraquinone-2-COOHRhein (1,8-dihydroxy-3-carboxyl anthraquinone)
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