Carquinostatin A

AlkaPlorer ID: AK028581

Synonym: 'Carquinostatin A'

IUPAC Name: 1-[(2R)-2-hydroxypropyl]-2-methyl-6-(3-methylbut-2-enyl)-9H-carbazole-3,4-dione

Structure

SMILES: CC(C)=CCC1=CC=C2NC3=C(C(=O)C(=O)C(C)=C3C[C@@H](C)O)C2=C1

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InChI: InChI=1S/C21H23NO3/c1-11(2)5-6-14-7-8-17-16(10-14)18-19(22-17)15(9-12(3)23)13(4)20(24)21(18)25/h5,7-8,10,12,22-23H,6,9H2,1-4H3/t12-/m1/s1

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InChIKey: GBIKJKJPENMVHL-GFCCVEGCSA-N

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Properties Information

Molecule Weight: 337.41900000000004

TPSA: 70.16

MolLogP: 3.9864000000000033

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information