Dielsine
AlkaPlorer ID: AK295599
Synonym: None
IUPAC Name: 27-hydroxy-16,26-dimethoxy-4,21-dimethyl-12,29,37-trioxa-4,21-diazaoctacyclo[28.2.2.17,11.110,14.114,18.124,28.03,8.022,36]octatriaconta-1(32),7(38),8,10,16,18(36),24(35),25,27,30,33-undecaen-15-one
Structure
SMILES: COC1=CC2=C3C(CC4=CC(=C(O)C(OC)=C4)OC4=CC=C(C=C4)CC4C5=C(C=C6OCC3(OC6=C5)C1=O)CCN4C)N(C)CC2
InChI: InChI=1S/C37H38N2O7/c1-38-11-9-23-17-29-30-19-26(23)27(38)13-21-5-7-25(8-6-21)45-32-16-22(15-31(42-3)35(32)40)14-28-34-24(10-12-39(28)2)18-33(43-4)36(41)37(34,46-30)20-44-29/h5-8,15-19,27-28,40H,9-14,20H2,1-4H3
InChIKey: UVAQBWNRDSCARL-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Daphnandra | Atherospermataceae | Laurales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 622.718
TPSA？: 89.93
MolLogP？: 5.144600000000006
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|