Phaeanthine; O7-De-Me, N2-β-oxide 

AlkaPlorer ID: AK309893

Synonym: Limacine 2β-N-oxide 

IUPAC Name: None

Structure

SMILES: COC1=CC=C2C=C1OC1=CC=C(C=C1)CC1C3=CC(=C(OC)C=C3CCN1C)OC1=C(O)C(OC)=CC3=C1C(C2)[N+](C)([O-])CC3

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InChI: InChI=1S/C37H40N2O7/c1-38-14-12-24-19-31(43-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)45-32-18-23(8-11-30(32)42-3)17-29-35-25(13-15-39(29,2)41)20-34(44-5)36(40)37(35)46-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3

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InChIKey: AJTCZGKUKUDSJU-UHFFFAOYSA-N

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Reference

CAS: 99883-66-6

Source

Properties Information

Molecule Weight: 624.734

TPSA: 92.68

MolLogP: 6.872000000000009

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information