FL-120C

AlkaPlorer ID: AK000870

Synonym: None

IUPAC Name: [(1S,2R,3R,4R)-2-acetyloxy-5-cyano-1,3,7-trihydroxy-3-methyl-6,11-dioxo-2,4-dihydro-1H-benzo[h]carbazol-4-yl] 2-methylpropanoate

Structure

SMILES: CC(=O)O[C@@H]1[C@@H](O)C2=C([C@@H](OC(=O)C(C)C)[C@@]1(C)O)N(C#N)C1=C2C(=O)C2=CC=CC(O)=C2C1=O

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InChI: InChI=1S/C24H22N2O9/c1-9(2)23(32)35-21-17-15(20(31)22(24(21,4)33)34-10(3)27)14-16(26(17)8-25)19(30)13-11(18(14)29)6-5-7-12(13)28/h5-7,9,20-22,28,31,33H,1-4H3/t20-,21+,22+,24+/m0/s1

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InChIKey: URROGYQLXVLJJM-JVNMPXIPSA-N

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Properties Information

Molecule Weight: 482.4450000000002

TPSA: 176.14999999999998

MolLogP: 1.26828

Number of H-Donors: 3

Number of H-Acceptors: 11

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information