17-hydroxydaphnigraciline
AlkaPlorer ID: AK132973
Synonym: None
IUPAC Name: methyl (1R,2'S,5S,9S,11R,12R,15R)-2'-ethyl-2',9-dihydroxy-3-methylspiro[3-azatetracyclo[6.5.1.11,5.011,14]pentadec-8(14)-ene-15,5'-oxane]-12-carboxylate
Structure
SMILES: CC[C@@]1(O)CC[C@@]2(CO1)[C@@H]1CCC3=C4[C@H](C[C@@H]3O)[C@H](C(=O)OC)C[C@@]42CN(C)C1
InChI: InChI=1S/C23H35NO5/c1-4-23(27)8-7-21(13-29-23)14-5-6-15-18(25)9-16-17(20(26)28-3)10-22(21,19(15)16)12-24(2)11-14/h14,16-18,25,27H,4-13H2,1-3H3/t14-,16-,17-,18+,21-,22-,23+/m1/s1
InChIKey: JQSUAFILVQFOIV-AEYAFFKOSA-N
Reference
Alkaloids from the Leaves of <i>Daphniphyllum subverticillatum</i>
PubChem CID: 162861751
LOTUS: LTS0063092
SuperNatural Ⅲ: SN0172682-03
NPASS: NPC306882
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Przewalskia tangutica | Przewalskia | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Erythrina variegata | Erythrina | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Holarrhena pubescens | Holarrhena | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 405.53500000000025
TPSA？: 79.22999999999999
MolLogP？: 2.0939
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|