(-)-O-Methylleucotamine

AlkaPlorer ID: AK145560

Synonym: 'O-Methylleucotamine'

IUPAC Name: [(1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-yl] (3R)-3-hydroxybutanoate

Structure

SMILES: COC1=CC=C2CN(C)CC[C@@]34C=C[C@H](OC(=O)C[C@@H](C)O)C[C@@H]3OC1=C24

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InChI: InChI=1S/C21H27NO5/c1-13(23)10-18(24)26-15-6-7-21-8-9-22(2)12-14-4-5-16(25-3)20(19(14)21)27-17(21)11-15/h4-7,13,15,17,23H,8-12H2,1-3H3/t13-,15+,17+,21+/m1/s1

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InChIKey: MJSGJSLIEXDCKY-VZBFBVBPSA-N

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Source

Properties Information

Molecule Weight: 373.4490000000002

TPSA: 68.23

MolLogP: 2.1721000000000004

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information