N-Methylhigenamine

AlkaPlorer ID: AK410794

Synonym: None

IUPAC Name: (1S)-1-[(4-hydroxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol

Structure

SMILES: CN1CCC2=CC(O)=C(O)C=C2[C@@H]1CC1=CC=C(O)C=C1

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InChI: InChI=1S/C17H19NO3/c1-18-7-6-12-9-16(20)17(21)10-14(12)15(18)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,19-21H,6-8H2,1H3/t15-/m0/s1

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InChIKey: IIOUIJTYVIHHEI-HNNXBMFYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Gnetum parvifolium Gnetum Gnetaceae Gnetales Gnetopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 285.343

TPSA: 63.93000000000001

MolLogP: 2.575100000000001

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT014749 C[SAH].Oc1ccc(C[C@@H]2NCCc3cc(O)c(O)cc32)cc1>>CN1CCc2cc(O)c(O)cc2[C@@H]1Cc1ccc(O)cc1 enzymemap_25895