(2S)-2-(dimethylamino)-N-[(3S,4S,7S)-3-isopropyl-7-(2-methylpropyl)-5,8-dioxo-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide
AlkaPlorer ID: AK530662
Synonym: None
IUPAC Name: 2-(dimethylamino)-N-[(10Z)-7-(2-methylpropyl)-5,8-dioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide
Structure
SMILES: CC(C)CC1N=C(O)C(N=C(O)C(CC2=CC=CC=C2)N(C)C)C(C(C)C)OC2=CC=C(/C=C\N=C1O)C=C2
InChI: InChI=1S/C31H42N4O4/c1-20(2)18-25-29(36)32-17-16-22-12-14-24(15-13-22)39-28(21(3)4)27(31(38)33-25)34-30(37)26(35(5)6)19-23-10-8-7-9-11-23/h7-17,20-21,25-28H,18-19H2,1-6H3,(H,32,36)(H,33,38)(H,34,37)/b17-16-
InChIKey: TVUQUDJOLFMOKT-MSUUIHNZSA-N
Reference
Protective Effects of Sanjoinine A against N-Methyl-D-aspartate-Induced Seizure
PubChem CID: 5317387
CAS: 19526-09-1
LOTUS: LTS0084638
NPASS: NPC317044
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Melochia corchorifolia | Melochia | Malvaceae | Malvales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 534.7010000000002
TPSA？: 110.24
MolLogP？: 5.900000000000006
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|