(1S,16R,17R)-4-hydroxy-5,17-dimethoxy-11-azatetracyclo[9.7.0.0¹,¹⁴.0²,⁷]octadeca-2(7),3,5,14-tetraen-16-yl acetate
AlkaPlorer ID: AK127087
Synonym: None
IUPAC Name: [(1S,16R,17R)-4-hydroxy-5,17-dimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraen-16-yl] acetate
Structure
SMILES: COC1=C(O)C=C2C(=C1)CCCN1CCC3=C[C@@H](OC(C)=O)[C@H](OC)C[C@]321
InChI: InChI=1S/C21H27NO5/c1-13(23)27-19-10-15-6-8-22-7-4-5-14-9-18(25-2)17(24)11-16(14)21(15,22)12-20(19)26-3/h9-11,19-20,24H,4-8,12H2,1-3H3/t19-,20-,21+/m1/s1
InChIKey: GRBIFEHYJNDLOS-NJYVYQBISA-N
Reference
Athrotaxis alkaloids. Part I. Alkaloids of A. Cupressoides
PubChem CID: 162919628
LOTUS: LTS0223606
SuperNatural Ⅲ: SN0113107-01
NPASS: NPC109987
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Athrotaxis cupressoides | Athrotaxis | Cupressaceae | Cupressales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 373.4490000000001
TPSA？: 68.23
MolLogP？: 2.524800000000001
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|