1-((3aR3a1S5aR10bR)-7-hydroxy-89-dimethoxy-2355a1112-hexahydro-1H-3a13a-(epoxyethano)indolizino[81-cd]carbazol-6(4H)-yl)ethanone
AlkaPlorer ID: AK020545
Synonym: None
IUPAC Name: 1-[(1R,4R,12R,16S)-7-hydroxy-8,9-dimethoxy-17-oxa-5,15-diazahexacyclo[13.4.3.01,16.04,12.06,11.012,16]docosa-6,8,10-trien-5-yl]ethanone
Structure
SMILES: COC1=CC2=C(C(O)=C1OC)N(C(C)=O)[C@@H]1CC[C@@]34CCCN5CC[C@@]21[C@]53OCC4
InChI: InChI=1S/C23H30N2O5/c1-14(26)25-17-5-7-21-6-4-10-24-11-8-22(17,23(21,24)30-12-9-21)15-13-16(28-2)20(29-3)19(27)18(15)25/h13,17,27H,4-12H2,1-3H3/t17-,21-,22-,23+/m1/s1
InChIKey: RRBZDBHWSABCEC-LUGPXAIHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspidosperma desmanthum | Aspidosperma | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 414.5020000000004
TPSA？: 71.47
MolLogP？: 2.778600000000001
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|