Cancentrine; 10-Oxo
AlkaPlorer ID: AK291529
Synonym: 10-Oxocancentrine
IUPAC Name: 14-hydroxy-8',10,15-trimethoxy-14'-methylspiro[12-oxa-4-azapentacyclo[9.7.2.04,19.07,20.013,18]icosa-1(19),7(20),8,10,13(18),14,16-heptaene-3,4'-6-oxa-14-azapentacyclo[9.5.1.01,5.02,13.07,17]heptadeca-7,9,11(17)-triene]-2,12'-dione
Structure
SMILES: COC1=CC=C2C3=C4C5=C(C=CC(OC)=C5OC2=C1O)CCN4C1(CC2C4C(=O)C5=CC=C(OC)C6=C5C2(CCN4C)C1O6)C3=O
InChI: InChI=1S/C36H32N2O8/c1-37-14-12-35-19-15-36(34(35)46-32-22(44-4)10-7-18(25(32)35)28(39)26(19)37)33(41)24-17-6-9-20(42-2)29(40)30(17)45-31-21(43-3)8-5-16-11-13-38(36)27(24)23(16)31/h5-10,19,26,34,40H,11-15H2,1-4H3
InChIKey: LKYZUDKLMJMIDF-UHFFFAOYSA-N
Reference
CAS: 68798-36-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Dicentra canadensis | Dicentra | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 620.6580000000001
TPSA？: 107.0
MolLogP？: 4.190900000000003
Number of H-Donors: 1
Number of H-Acceptors: 10
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|