Carquinostatin B

AlkaPlorer ID: AK028598

Synonym: 'Carquinostatin B'

IUPAC Name: 1-[(1S,2R)-1,2-dihydroxypropyl]-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)=C3[C@H](O)[C@@H](C)O)C2=C1

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InChI: InChI=1S/C21H23NO4/c1-10(2)5-6-13-7-8-15-14(9-13)17-18(22-15)16(20(25)12(4)23)11(3)19(24)21(17)26/h5,7-9,12,20,22-23,25H,6H2,1-4H3/t12-,20-/m1/s1

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InChIKey: YUNXXJUUIKKYDM-MPBGBICISA-N

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Properties Information

Molecule Weight: 353.418

TPSA: 90.39

MolLogP: 2.957200000000001

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information