{4,8,9-trihydroxy-6,16,18-trimethoxy-11-propyl-11-azahexacyclo[7.7.2.1²,?.0¹,¹?.0³,?.0¹³,¹?]nonadecan-13-yl}methyl 2-(3-ethyl-2,5-dioxopyrrolidin-1-yl)benzoate
AlkaPlorer ID: AK027276
Synonym: None
IUPAC Name: (4,8,9-trihydroxy-6,16,18-trimethoxy-11-propyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl)methyl 2-(3-ethyl-2,5-dioxopyrrolidin-1-yl)benzoate
Structure
SMILES: CCCN1CC2(COC(=O)C3=CC=CC=C3N3C(=O)CC(CC)C3=O)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6O)C(O)(C(OC)C23)C14
InChI: InChI=1S/C38H52N2O10/c1-6-14-39-18-35(19-50-33(44)21-10-8-9-11-24(21)40-27(41)15-20(7-2)32(40)43)13-12-26(48-4)37-23-16-22-25(47-3)17-36(45,28(23)29(22)42)38(46,34(37)39)31(49-5)30(35)37/h8-11,20,22-23,25-26,28-31,34,42,45-46H,6-7,12-19H2,1-5H3
InChIKey: NNJLQFGHDVXBQL-UHFFFAOYSA-N
Reference
Norditerpenoid alkaloids from Delphinium peregrinum var. elongatum
PubChem CID: 163061017
LOTUS: LTS0017281
COCONUT: CNP0350610
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Delphinium macrocentrum | Delphinium | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 696.8380000000005
TPSA？: 155.3
MolLogP？: 2.161200000000002
Number of H-Donors: 3
Number of H-Acceptors: 11
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|