1-(2-Amino-1-oxopropyl)-2,3,3a,13a,14,15,16,18a-octahydro-8-methoxy-5,9-metheno-9H-dipyrrolo[3,2-b:1',2'-e][1,5,8]oxadiazacyclopentadecine-13,18(1H,12H)-dione
AlkaPlorer ID: AK259359
Synonym: None
IUPAC Name: 6-(2-aminopropanoyl)-19-methoxy-2-oxa-6,9,15-triazatetracyclo[16.3.1.03,7.09,13]docosa-1(22),16,18,20-tetraene-8,14-dione
Structure
SMILES: COC1=CC=C2C=C1C=CNC(=O)C1CCCN1C(=O)C1C(CCN1C(=O)C(C)N)O2
InChI: InChI=1S/C22H28N4O5/c1-13(23)21(28)26-11-8-18-19(26)22(29)25-10-3-4-16(25)20(27)24-9-7-14-12-15(31-18)5-6-17(14)30-2/h5-7,9,12-13,16,18-19H,3-4,8,10-11,23H2,1-2H3,(H,24,27)
InChIKey: UUYIEJRNXIOEOB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sphaeranthus indicus | Sphaeranthus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 428.4890000000002
TPSA？: 114.2
MolLogP？: 0.4822000000000014
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|