Lutessine; O-De-Ac 

AlkaPlorer ID: AK304708

Synonym: Deacetyllutessine

IUPAC Name: 14-methoxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraene-17,18-diol

Structure

SMILES: COC1CN2CC3=CC4=C(C=C3C3C(O)C(O)C=C1C32)OCO4

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InChI: InChI=1S/C17H19NO5/c1-21-14-6-18-5-8-2-12-13(23-7-22-12)4-9(8)15-16(18)10(14)3-11(19)17(15)20/h2-4,11,14-17,19-20H,5-7H2,1H3

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InChIKey: AIBLAEJZRCMKFR-UHFFFAOYSA-N

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Reference

PubChem CID: 162843614

COCONUT: CNP0104309.1

Source

Properties Information

Molecule Weight: 317.3410000000001

TPSA: 71.39000000000001

MolLogP: 0.3734999999999998

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information