(1R,2R,5S,7S,10R,11S,14S,15S)-5-hydroxy-2,15-dimethyl-14-[(1S)-1-[(5R)-5-methyl-3,4,5,6-tetrahydropyridin-2-yl]ethyl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one
AlkaPlorer ID: AK097744
Synonym: None
IUPAC Name: (3S,5S,8S,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(1S)-1-[(3S)-3-methyl-2,3,4,5-tetrahydropyridin-6-yl]ethyl]-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
Structure
SMILES: C[C@H]1CCC([C@@H](C)[C@H]2CC[C@H]3[C@@H]4CC(=O)[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)=NC1
InChI: InChI=1S/C27H43NO2/c1-16-5-8-24(28-15-16)17(2)20-6-7-21-19-14-25(30)23-13-18(29)9-11-27(23,4)22(19)10-12-26(20,21)3/h16-23,29H,5-15H2,1-4H3/t16-,17-,18-,19-,20+,21-,22-,23+,26+,27+/m0/s1
InChIKey: QAGPPGDCPAPQLW-HAQROMNMSA-N
Reference
Circular dichroism of the alkaloids ofPetilium raddeanum
PubChem CID: 11875904
LOTUS: LTS0156370
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fritillaria raddeana | Fritillaria | Liliaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 413.6460000000003
TPSA？: 49.66
MolLogP？: 5.692200000000007
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|