(1S,2R,3R,4S,5R,6S,8S,9S,10R,13S,16S,17R)-8-ethoxy-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl acetate
AlkaPlorer ID: AK452643
Synonym: None
IUPAC Name: [8-ethoxy-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] acetate
Structure
SMILES: CCOC12CC(OC)C3CC(C1C3OC(C)=O)C13C(OC)CCC4(COC)CN(CC)C1C2CC43
InChI: InChI=1S/C28H45NO6/c1-7-29-14-26(15-31-4)10-9-22(33-6)28-18-11-17-20(32-5)13-27(34-8-2,19(25(28)29)12-21(26)28)23(18)24(17)35-16(3)30/h17-25H,7-15H2,1-6H3
InChIKey: MBNBAHNWJUHSQR-UHFFFAOYSA-N
Reference
Macrorhynines A and B, Two Novel Norditerpenoid Alkaloids from <i>Aconitum macrorhynchum</i>
PubChem CID: 13817023
CAS: 95690-59-8
LOTUS: LTS0262789
COCONUT: CNP0207556.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum forrestii | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 491.6690000000004
TPSA？: 66.46000000000001
MolLogP？: 3.146200000000003
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|