(+)-Mecambroline

AlkaPlorer ID: AK012175

Synonym: '', '(-)-Mecambroline', '(+)-Mecambroline', '(R)-(-)-Mecambroline'

IUPAC Name: (12R)-11-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-17-ol

Structure

SMILES: CN1CCC2=C3C(=C4OCOC4=C2)C2=CC(O)=CC=C2C[C@H]31

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InChI: InChI=1S/C18H17NO3/c1-19-5-4-11-7-15-18(22-9-21-15)17-13-8-12(20)3-2-10(13)6-14(19)16(11)17/h2-3,7-8,14,20H,4-6,9H2,1H3/t14-/m1/s1

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InChIKey: DYAAXURJUVSJEZ-CQSZACIVSA-N

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Properties Information

Molecule Weight: 295.338

TPSA: 41.93000000000001

MolLogP: 2.873000000000001

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information