Luteoalbusin A

AlkaPlorer ID: AK087041

Synonym: None

IUPAC Name: (1S,3S,11R,14S)-14-(hydroxymethyl)-3-(1H-indol-3-yl)-18-methyl-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4,6,8-triene-13,17-dione

Structure

SMILES: CN1C(=O)[C@@]23C[C@]4(C5=CNC6=CC=CC=C56)C5=CC=CC=C5N[C@@H]4N2C(=O)[C@]1(CO)SS3

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InChI: InChI=1S/C23H20N4O3S2/c1-26-19(29)22-11-21(15-10-24-16-8-4-2-6-13(15)16)14-7-3-5-9-17(14)25-18(21)27(22)20(30)23(26,12-28)32-31-22/h2-10,18,24-25,28H,11-12H2,1H3/t18-,21-,22+,23+/m1/s1

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InChIKey: XHPIWHHLWCZQEF-QQUTXWOLSA-N

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Properties Information

Molecule Weight: 464.5720000000002

TPSA: 88.67

MolLogP: 2.6898000000000013

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information