Daphnilongeranin D
AlkaPlorer ID: AK097523
Synonym: '', 'daphnilongeranin D'
IUPAC Name: (2S)-1-[(1S,4S,5R)-1,4-dimethyl-2,8-dioxabicyclo[3.2.1]octan-4-yl]-2-hydroxy-3-[(1R,2S,3R,7S,10R,13R,14S)-1-methyl-14-propan-2-yl-12-azapentacyclo[8.6.0.02,13.03,7.07,12]hexadecan-2-yl]propan-1-one
Structure
SMILES: CC(C)[C@@H]1CC[C@]2(C)[C@H]3CC[C@@]45CCC[C@@H]4[C@]2(C[C@H](O)C(=O)[C@@]2(C)CO[C@]4(C)CC[C@H]2O4)[C@@H]1N5C3
InChI: InChI=1S/C30H47NO4/c1-18(2)20-9-12-27(4)19-8-14-29-11-6-7-22(29)30(27,24(20)31(29)16-19)15-21(32)25(33)26(3)17-34-28(5)13-10-23(26)35-28/h18-24,32H,6-17H2,1-5H3/t19-,20-,21-,22-,23+,24+,26-,27+,28-,29-,30+/m0/s1
InChIKey: MZFIJLHWABOTEH-AQWSEZNASA-N
Reference
Alkaloids from <i>Daphniphyllum</i> <i>l</i><i>ongeracemosum</i>
PubChem CID: 163105139
LOTUS: LTS0257187
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Daphniphyllum oldhamii | Daphniphyllum | Daphniphyllaceae | Saxifragales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 485.7090000000003
TPSA？: 59.00000000000001
MolLogP？: 4.943600000000004
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|