19-O-deethyl spiramine N
AlkaPlorer ID: AK043292
Synonym: ''
IUPAC Name: (1R,2S,4S,6S,7R,8R,10S,11R,12R)-11-methyl-5-methylidene-13-azapentacyclo[9.3.3.24,7.01,10.02,7]nonadec-13-ene-6,8,12-triol
Structure
SMILES: C=C1[C@H]2CC[C@@]3([C@H](O)C[C@@H]4[C@@]5(C)CCC[C@@]4(C=N[C@@H]5O)[C@@H]3C2)[C@H]1O
InChI: InChI=1S/C20H29NO3/c1-11-12-4-7-20(16(11)23)14(8-12)19-6-3-5-18(2,17(24)21-10-19)13(19)9-15(20)22/h10,12-17,22-24H,1,3-9H2,2H3/t12-,13+,14-,15+,16-,17+,18+,19-,20+/m0/s1
InChIKey: DTWRNBPLILRYBH-KDRUZJHHSA-N
Reference
New Spiramines from Spiraea japonica var. ovalifolia
PubChem CID: 101104082
LOTUS: LTS0070253
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Spiraea japonica | Spiraea | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 331.456
TPSA？: 73.05000000000001
MolLogP？: 2.2800000000000007
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|