O-Demethyllycoramine

AlkaPlorer ID: AK158927

Synonym: ''

IUPAC Name: (1S,12S,14S)-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9-triene-9,14-diol

Structure

SMILES: CN1CC[C@]23CC[C@H](O)C[C@@H]2OC2=C(O)C=CC(=C23)C1

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InChI: InChI=1S/C16H21NO3/c1-17-7-6-16-5-4-11(18)8-13(16)20-15-12(19)3-2-10(9-17)14(15)16/h2-3,11,13,18-19H,4-9H2,1H3/t11-,13-,16+/m0/s1

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InChIKey: SPGYGGXZMAHIKN-DETPVDSQSA-N

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Source

Properties Information

Molecule Weight: 275.348

TPSA: 52.93000000000001

MolLogP: 1.7713

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information