12beta-Hydroxykarasamine
AlkaPlorer ID: AK041801
Synonym: ''
IUPAC Name: (1R,2S,3R,4S,5R,6R,8S,9S,10R,13R,16R,17R)-11-ethyl-4,6-dimethoxy-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-2,8,16-triol
Structure
SMILES: CCN1C[C@]2(C)CC[C@@H](O)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]1(O)C[C@@H](OC)[C@H]2C[C@]4(O)[C@@H]1[C@H]2OC
InChI: InChI=1S/C23H37NO5/c1-5-24-11-20(2)7-6-16(25)23-15(20)8-13(19(23)24)21(26)10-14(28-3)12-9-22(23,27)18(21)17(12)29-4/h12-19,25-27H,5-11H2,1-4H3/t12-,13+,14-,15-,16-,17+,18-,19-,20+,21+,22+,23+/m1/s1
InChIKey: JQRBIDFJGMVSMU-YJBUWYFZSA-N
Reference
Diterpenoid and norditerpenoid alkaloids fromDelphinium nuttallianum
PubChem CID: 163104609
LOTUS: LTS0195337
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium nuttallianum | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 407.55100000000016
TPSA？: 82.39000000000001
MolLogP？: 1.0196
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|