isovobtusine-N-oxide
AlkaPlorer ID: AK015710
Synonym: None
IUPAC Name: None
Structure
SMILES: COC(C1=C2NC3=CC=CC=C3[C@@]24CCN5C[C@@]6(C7(OCCC7(C45[H])C1)[H])CN8C9=C(C=CC=C9[C@@]%10%11CCN%12CC[C@@]%13(OCC[C@@]%13([C@@]%11%12[H])C[C@@](C6)([C@]8%10O)[H])[H])OC)=O
InChI: InChI=1S/C43H50N4O6/c1-50-30-9-5-7-28-32(30)47-24-38(20-25-21-39-13-18-52-31(39)10-15-45-17-12-42(28,36(39)45)43(25,47)49)23-46-16-11-41-27-6-3-4-8-29(27)44-33(41)26(34(48)51-2)22-40(35(41)46)14-19-53-37(38)40/h3-9,25,31,35-37,44,49H,10-24H2,1-2H3/t25-,31+,35?,36+,37?,38-,39-,40?,41+,42-,43-/m1/s1
InChIKey: IIMPGJMHQMBXKL-KGZCAJKKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Voacanga grandifolia | Voacanga | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 718.8950000000001
TPSA？: 95.97000000000003
MolLogP？: 4.162400000000003
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 13
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|