Akuammicine; (-)-form, 12-Methoxy, 19α,20α-epoxide
AlkaPlorer ID: AK283645
Synonym: 12-Methoxy-19α,20α-epoxyakuammicine
IUPAC Name: methyl 6-methoxy-3'-methylspiro[8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2(7),3,5,9-tetraene-12,2'-oxirane]-10-carboxylate
Structure
SMILES: COC(=O)C1=C2NC3=C(OC)C=CC=C3C23CCN2CC4(OC4C)C1CC23
InChI: InChI=1S/C21H24N2O4/c1-11-21(27-11)10-23-8-7-20-12-5-4-6-14(25-2)17(12)22-18(20)16(19(24)26-3)13(21)9-15(20)23/h4-6,11,13,15,22H,7-10H2,1-3H3
InChIKey: OMNODBHMNRZDEA-UHFFFAOYSA-N
Reference
Alkaloids of Alstonia lenormandii, a structural revision of 10-methoxycompactinervine
PubChem CID: 162874320
LOTUS: LTS0053277
COCONUT: CNP0139242.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Amsonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 368.43300000000016
TPSA？: 63.330000000000005
MolLogP？: 2.0508999999999995
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|