2,21-dimethyl (1S,12R,19R,24S)-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.1¹²,¹⁵.0¹,¹².0³,¹¹.0⁴,⁸.0¹⁹,²⁴]tetracosa-3(11),4(8),9,20-tetraene-2,21-dicarboxylate
AlkaPlorer ID: AK241815
Synonym: None
IUPAC Name: dimethyl (1S,12R,19R,24S)-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.112,15.01,12.03,11.04,8.019,24]tetracosa-3(11),4(8),9,20-tetraene-2,21-dicarboxylate
Structure
SMILES: COC(=O)C1=C[C@@]23CCCN4CC[C@@]5(C6=CC=C7OCOC7=C6N(C(=O)OC)[C@]15CC2)[C@@H]43
InChI: InChI=1S/C24H26N2O6/c1-29-19(27)15-12-22-6-3-10-25-11-9-23(20(22)25)14-4-5-16-18(32-13-31-16)17(14)26(21(28)30-2)24(15,23)8-7-22/h4-5,12,20H,3,6-11,13H2,1-2H3/t20-,22+,23+,24+/m0/s1
InChIKey: HAZJGQFYTPRNBW-MZURWIMNSA-N
Reference
Dehydropleiocarpine alkaloids from Kopsia profunda
PubChem CID: 102056165
LOTUS: LTS0236903
SuperNatural Ⅲ: SN0120674-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia profunda | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 438.4800000000003
TPSA？: 77.54
MolLogP？: 2.739600000000001
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|