N-[(1S,3R,6S,8R,11S,12S,16S)-15-acetyl-12,16-dimethyl-7-methylidenepentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadec-14-en-6-yl]-N-methylacetamide
AlkaPlorer ID: AK395819
Synonym: None
IUPAC Name: N-(15-acetyl-12,16-dimethyl-7-methylidene-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadec-14-enyl)-N-methylacetamide
Structure
SMILES: C=C1C(N(C)C(C)=O)CCC23CC24CCC2(C)C(C(C)=O)=CCC2(C)C4CCC13
InChI: InChI=1S/C26H37NO2/c1-16-19-7-8-22-24(5)11-9-20(17(2)28)23(24,4)13-14-26(22)15-25(19,26)12-10-21(16)27(6)18(3)29/h9,19,21-22H,1,7-8,10-15H2,2-6H3
InChIKey: HALJBSNTDPUVQJ-UHFFFAOYSA-N
Reference
Four steroidal alkaloids from Buxus papilosa
PubChem CID: 14109889
LOTUS: LTS0104594
COCONUT: CNP0288825.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Buxus papillosa | Buxus | Buxaceae | Buxales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 395.58700000000016
TPSA？: 37.38
MolLogP？: 5.311500000000006
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|