Impranine
AlkaPlorer ID: AK015790
Synonym: ''
IUPAC Name: (3S,4aS,6aS,6bR,9S,10aR,11aR,11bR)-9-[(1S)-1-[(2S,5S)-1,5-dimethylpiperidin-2-yl]ethyl]-3-hydroxy-10a,11b-dimethyl-1,2,3,4,4a,6,6a,6b,9,10,11,11a-dodecahydrobenzo[a]fluoren-5-one
Structure
SMILES: C[C@H]1CC[C@@H]([C@@H](C)[C@@H]2C=C[C@@H]3[C@H]4CC(=O)[C@H]5C[C@@H](O)CC[C@]5(C)[C@@H]4C[C@@]3(C)C2)N(C)C1
InChI: InChI=1S/C28H45NO2/c1-17-6-9-25(29(5)16-17)18(2)19-7-8-22-21-13-26(31)23-12-20(30)10-11-28(23,4)24(21)15-27(22,3)14-19/h7-8,17-25,30H,6,9-16H2,1-5H3/t17-,18-,19+,20-,21+,22+,23+,24+,25-,27+,28-/m0/s1
InChIKey: YWTDTKWYDRWAKX-BDHLFTEASA-N
Reference
New class of steroidal alkaloids from Fritillaria imperialis
PubChem CID: 639687
LOTUS: LTS0135365
NPASS: NPC89070
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fritillaria imperialis | Fritillaria | Liliaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 427.6730000000003
TPSA？: 40.54
MolLogP？: 5.327600000000006
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|