7-hydroxy-12-(3-hydroxy-4-methoxyphenyl)-8,16,17-trimethoxy-4-oxa-1-azapentacyclo[11.8.0.0²,¹¹.0?,¹?.0¹?,¹?]henicosa-5,7,9,12,14,16,18,20-octaen-3-one
AlkaPlorer ID: AK004352
Synonym: None
IUPAC Name: 7-hydroxy-12-(3-hydroxy-4-methoxyphenyl)-8,16,17-trimethoxy-4-oxa-1-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-5,7,9,12,14,16,18,20-octaen-3-one
Structure
SMILES: COC1=CC=C(C2=C3C4=CC(OC)=C(OC)C=C4C=CN3C3C(=O)OC4=CC(O)=C(OC)C=C4C23)C=C1O
InChI: InChI=1S/C29H25NO8/c1-34-20-6-5-15(9-18(20)31)25-26-17-12-22(35-2)19(32)13-21(17)38-29(33)28(26)30-8-7-14-10-23(36-3)24(37-4)11-16(14)27(25)30/h5-13,26,28,31-32H,1-4H3
InChIKey: PYYHFDZTWYLLTG-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Didemnidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 515.5180000000003
TPSA？: 106.92000000000002
MolLogP？: 4.371800000000005
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|