(1S,2S,4S,6S,10R,11R,13S,14R)-8-ethyl-13,15-dimethoxy-5-oxa-8-azaheptacyclo[8.7.2.114,17.01,9.04,6.06,18.011,16]icosane-2,10,11-triol
AlkaPlorer ID: AK502009
Synonym: None
IUPAC Name: (1S,2S,4S,6S,10R,11R,13S,14R)-8-ethyl-13,15-dimethoxy-5-oxa-8-azaheptacyclo[8.7.2.114,17.01,9.04,6.06,18.011,16]icosane-2,10,11-triol
Structure
SMILES: CCN1C[C@]23O[C@H]2C[C@H](O)[C@@]24C5C[C@H]6C(OC)C5[C@](O)(C[C@@H]6OC)[C@@](O)(CC23)C14
InChI: InChI=1S/C22H33NO6/c1-4-23-9-19-13-8-21(26)18(23)22(13,14(24)6-15(19)29-19)11-5-10-12(27-2)7-20(21,25)16(11)17(10)28-3/h10-18,24-26H,4-9H2,1-3H3/t10-,11?,12+,13?,14+,15+,16?,17?,18?,19-,20-,21-,22-/m1/s1
InChIKey: QMPMWGJFHADPSW-GLHPDKHTSA-N
Reference
Deoxydelsoline and dihydromonticamine fromAconitum monticola
PubChem CID: 145994505
LOTUS: LTS0208223
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aconitum monticola | Aconitum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 407.5070000000002
TPSA？: 94.92000000000002
MolLogP？: -0.2391999999999983
Number of H-Donors: 3
Number of H-Acceptors: 7
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|