Palmerolide A; N-Deacyl, N-(3,5-dimethyl-2Z,5-hexadienoyl)
AlkaPlorer ID: AK309232
Synonym: Palmerolide D
IUPAC Name: [2-[6-(3,5-dimethylhexa-2,5-dienoylamino)-4-methylhexa-3,5-dien-2-yl]-11,14-dihydroxy-4-methyl-20-oxo-1-oxacycloicosa-4,6,12,18-tetraen-10-yl] carbamate
Structure
SMILES: C=C(C)CC(C)=CC(O)=NC=CC(C)=CC(C)C1CC(C)=CC=CCCC(OC(=N)O)C(O)C=CC(O)CCCC=CC(=O)O1
InChI: InChI=1S/C36H52N2O7/c1-25(2)21-28(5)24-34(41)38-20-19-27(4)22-29(6)33-23-26(3)13-9-7-11-15-32(45-36(37)43)31(40)18-17-30(39)14-10-8-12-16-35(42)44-33/h7,9,12-13,16-20,22,24,29-33,39-40H,1,8,10-11,14-15,21,23H2,2-6H3,(H2,37,43)(H,38,41)
InChIKey: FCKRUGBQFSKMHB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Synoicum adareanum | Synoicum | Polyclinidae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 624.8190000000001
TPSA？: 152.66000000000005
MolLogP？: 7.432170000000009
Number of H-Donors: 5
Number of H-Acceptors: 7
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|