Spiramine H
AlkaPlorer ID: AK078534
Synonym: ''
IUPAC Name: (1S,2S,4R,7R,10R,11R,18S)-18-hydroxy-13-(2-hydroxyethyl)-11-methyl-19-methylidene-13-azapentacyclo[9.3.3.24,7.01,10.02,7]nonadecan-6-one
Structure
SMILES: C=C1[C@H]2CC(=O)[C@@]3(CC[C@@H]4[C@@]5(C)CCC[C@@]4(CN(CCO)C5)[C@@H]3C2)[C@H]1O
InChI: InChI=1S/C22H33NO3/c1-14-15-10-17-21-6-3-5-20(2,12-23(13-21)8-9-24)16(21)4-7-22(17,19(14)26)18(25)11-15/h15-17,19,24,26H,1,3-13H2,2H3/t15-,16-,17+,19+,20+,21+,22+/m1/s1
InChIKey: CYKBPNPUBPPKTH-BCBLRFMSSA-N
Reference
Two New Diterpenoid Alkaloids, Beiwusines A and B, from<i>Aconitum kusnezoffii</i>
PubChem CID: 101104087
LOTUS: LTS0053607
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Spiraea japonica | Spiraea | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 359.5100000000001
TPSA？: 60.77000000000001
MolLogP？: 2.3933000000000004
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|