piepunensine A
AlkaPlorer ID: AK152626
Synonym: '', 'Piepunensine A'
IUPAC Name: (1S,2R,3R,4R,5S,6S,8S,9S,10R,13R,16S,17S)-4,8-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-12-one
Structure
SMILES: COC[C@@]12CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]13)[C@H]4N=C2O
InChI: InChI=1S/C22H33NO6/c1-27-9-20-5-4-15(29-3)22-11-6-10-13(28-2)8-21(26,16(11)17(10)24)12(7-14(20)22)18(22)23-19(20)25/h10-18,24,26H,4-9H2,1-3H3,(H,23,25)/t10-,11-,12+,13+,14-,15+,16-,17-,18-,20+,21+,22-/m1/s1
InChIKey: XGNLVYXRWSQUKE-PGFKDEHDSA-N
Reference
New C19-Diterpenoid Alkaloids from Aconitum piepunense
PubChem CID: 162919837
LOTUS: LTS0232546
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum piepunense | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 407.5070000000002
TPSA？: 100.74
MolLogP？: 1.1658
Number of H-Donors: 3
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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