Sempervirone
AlkaPlorer ID: AK004380
Synonym: ''
IUPAC Name: (1R,3S,6R,7Z,10R,11R,14S,15S,20S)-7-ethylidene-6,10,15,19-tetramethyl-17-oxa-19-azahexacyclo[12.8.0.01,3.03,11.06,10.015,20]docosan-8-one
Structure
SMILES: C/C=C1\C(=O)C[C@]2(C)[C@H]3CC[C@@H]4[C@]5(C)COCN(C)[C@H]5CC[C@@]45C[C@@]35CC[C@@]12C
InChI: InChI=1S/C26H39NO2/c1-6-17-18(28)13-24(4)20-8-7-19-22(2)15-29-16-27(5)21(22)9-10-25(19)14-26(20,25)12-11-23(17,24)3/h6,19-21H,7-16H2,1-5H3/b17-6+/t19-,20-,21+,22+,23+,24-,25-,26+/m1/s1
InChIKey: LQEYGBHACPWUTB-ASHNFCJTSA-N
Reference
The Isolation and Structure of “Harappamine” — A New Alkaloid from Buxus papilosa
PubChem CID: 162877442
LOTUS: LTS0084878
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Buxus sempervirens | Buxus | Buxaceae | Buxales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 397.6030000000002
TPSA？: 29.54
MolLogP？: 5.202800000000006
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|