Cassaidine; 7-Ketone, 3-O-(3-methyl-2-butenoyl)
AlkaPlorer ID: AK291794
Synonym: 3-(3-Methylcrotonyl)cassaine
IUPAC Name: None
Structure
SMILES: CC(C)=CC(=O)OC1CCC2(C)C3CC/C(=C/C(=O)OCCN(C)C)C(C)C3C(=O)CC2C1(C)C
InChI: InChI=1S/C29H45NO5/c1-18(2)15-26(33)35-24-11-12-29(6)21-10-9-20(16-25(32)34-14-13-30(7)8)19(3)27(21)22(31)17-23(29)28(24,4)5/h15-16,19,21,23-24,27H,9-14,17H2,1-8H3/b20-16-
InChIKey: ZUDBXDCWBRLISQ-SILNSSARSA-N
Reference
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Erythrophleum ivorense | Erythrophleum | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 487.6810000000003
TPSA？: 72.91000000000001
MolLogP？: 4.973200000000005
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|