Ezochasmanine
AlkaPlorer ID: AK044230
Synonym: '', 'MLS000728661', '3-Hydroxychasmanine', 'SMR000470834'
IUPAC Name: None
Structure
SMILES: CC[NH+]1C[C@]2(COC)[C@H](O)C[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@H](OC)[C@H]23)[C@@H]14
InChI: InChI=1S/C25H41NO7/c1-6-26-10-23(11-30-2)15(27)8-16(32-4)25-13-7-12-14(31-3)9-24(29,17(13)19(12)28)18(22(25)26)20(33-5)21(23)25/h12-22,27-29H,6-11H2,1-5H3/p+1/t12-,13-,14+,15-,16+,17-,18+,19+,20+,21-,22-,23+,24-,25+/m1/s1
InChIKey: DQEABNIOXCZHOW-UIMAUDTQSA-O
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Duranta erecta | Duranta | Verbenaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Aconitum hemsleyanum | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 468.61100000000016
TPSA？: 102.05000000000004
MolLogP？: -1.290199999999993
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|