trans-Cyclosuffrobuxinine
AlkaPlorer ID: AK066110
Synonym: ''
IUPAC Name: (1S,3R,6S,8R,11S,12S,15Z,16S)-15-ethylidene-12,16-dimethyl-6-(methylamino)-7-methylidenepentacyclo[9.7.0.01,3.03,8.012,16]octadecan-14-one
Structure
SMILES: C=C1[C@@H](NC)CC[C@]23C[C@]24CC[C@]2(C)/C(=C/C)C(=O)C[C@@]2(C)[C@@H]4CC[C@@H]13
InChI: InChI=1S/C24H35NO/c1-6-16-19(26)13-22(4)20-8-7-17-15(2)18(25-5)9-10-23(17)14-24(20,23)12-11-21(16,22)3/h6,17-18,20,25H,2,7-14H2,1,3-5H3/b16-6+/t17-,18-,20-,21+,22-,23+,24-/m0/s1
InChIKey: RGADTGZXHGYDQJ-LTZKVTMUSA-N
Reference
New Steroidal Alkaloids from <i>Buxus</i> <i>longifolia</i>
PubChem CID: 101280215
LOTUS: LTS0241677
SuperNatural Ⅲ: SN0324326-04
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Buxus balearica | Buxus | Buxaceae | Buxales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 353.5500000000002
TPSA？: 29.1
MolLogP？: 5.052600000000005
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|