Ancistrocongoline C

AlkaPlorer ID: AK012354

Synonym: '', 'Ancistrobertsonine A', 'Ancistrocongoline C'

IUPAC Name: (1S,3S)-5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-6-ol

Structure

SMILES: COC1=CC(O)=C(C2=CC=C(OC)C3=C(OC)C=C(C)C=C23)C2=C1[C@H](C)N(C)[C@@H](C)C2

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InChI: InChI=1S/C26H31NO4/c1-14-10-18-17(8-9-21(29-5)26(18)22(11-14)30-6)25-19-12-15(2)27(4)16(3)24(19)23(31-7)13-20(25)28/h8-11,13,15-16,28H,12H2,1-7H3/t15-,16-/m0/s1

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InChIKey: RNLKCMIGQLHEKX-HOTGVXAUSA-N

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Properties Information

Molecule Weight: 421.5370000000002

TPSA: 51.16

MolLogP: 5.484020000000005

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information