4-Methylaconitane-1,6,7,8,10,14,16-heptol; (1α,6β,14α,16β)-form, 7,8-Methylene, O1,O16-di-Me, N-Et, 14-O-(2-methylpropanoyl), 6-Ac
AlkaPlorer ID: AK305807
Synonym: Glaucerine, 14-Isobutyryldictyocarpine
IUPAC Name: (21-acetyloxy-14-ethyl-2-hydroxy-6,19-dimethoxy-16-methyl-9,11-dioxa-14-azaheptacyclo[10.7.2.12,5.01,13.03,8.08,12.016,20]docosan-4-yl) 2-methylpropanoate
Structure
SMILES: CCN1CC2(C)CCC(OC)C34C2C(OC(C)=O)C2(OCOC25CC(OC)C2CC3(O)C5C2OC(=O)C(C)C)C14
InChI: InChI=1S/C30H45NO9/c1-8-31-13-26(5)10-9-19(36-7)29-22(26)23(39-16(4)32)30(25(29)31)28(37-14-38-30)12-18(35-6)17-11-27(29,34)21(28)20(17)40-24(33)15(2)3/h15,17-23,25,34H,8-14H2,1-7H3
InChIKey: CTIUZFAMJMQFHC-UHFFFAOYSA-N
Reference
Three New C19-Diterpenoid Alkaloids from Delphinium occidentale S. Wats.
PubChem CID: 157146
CAS: 78018-29-8
LOTUS: LTS0105660
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium glaucescens | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 563.6880000000003
TPSA？: 112.99
MolLogP？: 1.902700000000002
Number of H-Donors: 1
Number of H-Acceptors: 10
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|