Akuammicine; (±)-form
AlkaPlorer ID: AK283633
Synonym: Pseudakuammicine, Pseudoakuammicine
IUPAC Name: methyl 12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate
Structure
SMILES: CC=C1CN2CCC34C(=C(C(=O)OC)C1CC23)NC1=CC=CC=C14
InChI: InChI=1S/C20H22N2O2/c1-3-12-11-22-9-8-20-14-6-4-5-7-15(14)21-18(20)17(19(23)24-2)13(12)10-16(20)22/h3-7,13,16,21H,8-11H2,1-2H3
InChIKey: AGZMFTKKLPHOMT-UHFFFAOYSA-N
Reference
Alkaloids of<i>Vinca major</i>cv.<i>variegata</i>*
PubChem CID: 5087855
CAS: 639-43-0
LOTUS: LTS0047727
COCONUT: CNP0166874.8
Source
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Properties Information
Molecule Weight: 322.408
TPSA？: 41.57
MolLogP？: 2.831100000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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