kopsiloscine F

AlkaPlorer ID: AK140849

Synonym: '', 'Kopsinganol'

IUPAC Name: dimethyl (1S,9R,15S,16S,17R,18R,21R)-15,17,18-trihydroxy-4-methoxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3(8),4,6-triene-2,18-dicarboxylate

Structure

SMILES: COC(=O)N1C2=C(OC)C=CC=C2[C@@]23CCN4CC[C@H](O)[C@]5(CC[C@]12[C@](O)(C(=O)OC)[C@@H]5O)[C@H]43

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InChI: InChI=1S/C24H30N2O8/c1-32-14-6-4-5-13-16(14)26(20(30)34-3)23-9-8-21(18(28)24(23,31)19(29)33-2)15(27)7-11-25-12-10-22(13,23)17(21)25/h4-6,15,17-18,27-28,31H,7-12H2,1-3H3/t15-,17-,18+,21+,22+,23-,24+/m0/s1

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InChIKey: GDGFOGDXGVRMOU-SYUAKYNNSA-N

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Properties Information

Molecule Weight: 474.5100000000003

TPSA: 129.0

MolLogP: 0.1559000000000003

Number of H-Donors: 3

Number of H-Acceptors: 9

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
None Epidermoid carcinoma cell line IC50 None ug.mL-1 10.1016/s0960-894x(98)00486-7

Metabolism Information