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isolapidilectine A

AlkaPlorer ID: AK051349

Synonym: '', '(-)-Lapidilectine A', 'rel-Trimethyl (1R,9S,16R,18R)-2,12-diazapentacyclo14.2.2.01,9.03,8.012,16icosa-3,5,7,14-tetraene-2,9,18-tricarboxylate', 'lapidilectine A, (rel)-', 'Trimethyl (1R,9S,16R,18S)-2,12-diazapentacyclo14.2.2.01,9.03,8.012,16icosa-3,5,7,14-tetraene-2,9,18-tricarboxylate'

IUPAC Name: trimethyl (1R,9S,16R,18R)-2,12-diazapentacyclo[14.2.2.01,9.03,8.012,16]icosa-3,5,7,14-tetraene-2,9,18-tricarboxylate

Structure

SMILES: COC(=O)[C@@H]1C[C@]23C=CCN2CC[C@]2(C(=O)OC)C4=CC=CC=C4N(C(=O)OC)[C@]12CC3

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InChI: InChI=1S/C24H28N2O6/c1-30-19(27)17-15-22-9-6-13-25(22)14-12-23(20(28)31-2)16-7-4-5-8-18(16)26(21(29)32-3)24(17,23)11-10-22/h4-9,17H,10-15H2,1-3H3/t17-,22+,23+,24+/m0/s1

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InChIKey: YLBUDFTWGUSIKB-QKBJRNKPSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Kopsia grandifolia Kopsia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 440.4960000000002

TPSA？: 85.38000000000001

MolLogP？: 2.41

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information