Phaeanthine; N2,N2'-Di-de-Me 

AlkaPlorer ID: AK309894

Synonym: 2,2'-Bisnorphaeanthine

IUPAC Name: 9,20,21,25-tetramethoxy-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaene

Structure

SMILES: COC1=CC=C2C=C1OC1=CC=C(C=C1)CC1NCCC3=C1C=C(OC1=C4C(=CC(OC)=C1OC)CCNC4C2)C(OC)=C3

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InChI: InChI=1S/C36H38N2O6/c1-39-29-10-7-22-16-28-34-24(12-14-38-28)19-33(41-3)35(42-4)36(34)44-32-20-26-23(18-30(32)40-2)11-13-37-27(26)15-21-5-8-25(9-6-21)43-31(29)17-22/h5-10,17-20,27-28,37-38H,11-16H2,1-4H3

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InChIKey: YOVFYCDDECDCPN-UHFFFAOYSA-N

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Reference

PubChem CID: 162979983

CAS: 110360-02-6

COCONUT: CNP0252037.1

Source

Properties Information

Molecule Weight: 594.7080000000003

TPSA: 79.44000000000001

MolLogP: 6.478000000000006

Number of H-Donors: 2

Number of H-Acceptors: 8

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information