Myrianthine A
AlkaPlorer ID: AK185175
Synonym: ''
IUPAC Name: (2R)-N-[(3R,4R,7R,10E)-7-[(2S)-butan-2-yl]-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-2-(dimethylamino)hexanamide
Structure
SMILES: CCCC[C@H](C(O)=N[C@H]1C(O)=N[C@H]([C@@H](C)CC)C(O)=N/C=C/C2=CC=C(C=C2)O[C@@H]1C1=CC=CC=C1)N(C)C
InChI: InChI=1S/C31H42N4O4/c1-6-8-14-25(35(4)5)29(36)34-27-28(23-12-10-9-11-13-23)39-24-17-15-22(16-18-24)19-20-32-30(37)26(21(3)7-2)33-31(27)38/h9-13,15-21,25-28H,6-8,14H2,1-5H3,(H,32,37)(H,33,38)(H,34,36)/b20-19+/t21-,25+,26+,27+,28+/m0/s1
InChIKey: LPDQFEUVGGZEQL-INLFZQDDSA-N
Reference
Cyclopeptides from the Bark of <i>Discaria </i><i>a</i><i>mericana</i>
PubChem CID: 163104925
LOTUS: LTS0061927
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Discaria americana | Discaria | Rhamnaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 534.7010000000001
TPSA？: 110.24
MolLogP？: 6.564200000000006
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|