Peimisine
AlkaPlorer ID: AK309532
Synonym: Alkaloid FR 5, Ebeiensine
IUPAC Name: 3-hydroxy-3',6',10,11b-tetramethylspiro[1,2,3,4,4a,6,6a,6b,7,8,11,11a-dodecahydrobenzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-5-one
Structure
SMILES: CC1=C2CC3C(CC(=O)C4CC(O)CCC43C)C2CCC12OC1CC(C)CNC1C2C
InChI: InChI=1S/C27H41NO3/c1-14-9-24-25(28-13-14)16(3)27(31-24)8-6-18-19(15(27)2)11-21-20(18)12-23(30)22-10-17(29)5-7-26(21,22)4/h14,16-18,20-22,24-25,28-29H,5-13H2,1-4H3
InChIKey: KYELXPJVGNZIGC-UHFFFAOYSA-N
Reference
PubChem CID: 5320448
CAS: 157088-98-7
LOTUS: LTS0162003
NPASS: NPC127754
COCONUT: CNP0306350.5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Fritillaria | Fritillariidae | Copelata | Appendicularia | Chordata | Metazoa | Eukaryota |
| Fritillaria ebeiensis | Fritillaria | Liliaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Fritillaria | Fritillariidae | Copelata | Appendicularia | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 427.62900000000025
TPSA？: 58.56
MolLogP？: 4.260800000000003
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|