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150044-68-1 | 1H-Pyrrole-2,5-dicarboxylic acid, 3,4-di-1H-indol-3-yl-
CAS No: 150044-68-1 Catalog No: AG001M9S MDL No:
Product Description
Catalog Number:
AG001M9S
Chemical Name:
1H-Pyrrole-2,5-dicarboxylic acid, 3,4-di-1H-indol-3-yl-
CAS Number:
150044-68-1
Molecular Formula:
C22H15N3O4
Molecular Weight:
385.3722
IUPAC Name:
3,4-bis(1H-indol-3-yl)-1H-pyrrole-2,5-dicarboxylic acid
InChI:
InChI=1S/C22H15N3O4/c26-21(27)19-17(13-9-23-15-7-3-1-5-11(13)15)18(20(25-19)22(28)29)14-10-24-16-8-4-2-6-12(14)16/h1-10,23-25H,(H,26,27)(H,28,29)
InChI Key:
FZDVNXHYGMEEDT-UHFFFAOYSA-N
SMILES:
OC(=O)c1[nH]c(c(c1c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2)C(=O)O
Properties
Complexity:
604
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.106g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
385.379g/mol
Monoisotopic Mass:
385.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Literature
| Title | Journal |
|---|---|
| Total synthesis of lycogarubin C and lycogalic acid. | Organic letters 20100305 |
| Production of chromopyrrolic acid by coexpression of inkOD in a heterologous host Streptomyces albus. | Bioorganic & medicinal chemistry letters 20090315 |
| Lynamicins A-E, chlorinated bisindole pyrrole antibiotics from a novel marine actinomycete. | Journal of natural products 20081001 |
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