(1S,6R,8R,11R,12R,13S,23R)-16-hydroxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-15(20),16,18-triene-21,24-dione
AlkaPlorer ID: AK004971
Synonym: None
IUPAC Name: (1S,6R,8R,11R,23R,24R,25S)-16-hydroxy-4-methyl-7,10-dioxa-4,14-diazaheptacyclo[12.6.5.01,25.06,8.06,23.011,24.015,20]pentacosa-15(20),16,18-triene-13,21-dione
Structure
SMILES: CN1CC[C@@]23C(=O)C[C@@H]4[C@@H]5[C@@H]2N(C(=O)C[C@H]5OC[C@H]2O[C@@]42C1)C1=C(O)C=CC=C13
InChI: InChI=1S/C22H24N2O5/c1-23-6-5-21-11-3-2-4-13(25)19(11)24-17(27)8-14-18(20(21)24)12(7-15(21)26)22(10-23)16(29-22)9-28-14/h2-4,12,14,16,18,20,25H,5-10H2,1H3/t12-,14-,16-,18+,20+,21-,22+/m1/s1
InChIKey: LNLMCLDEZUWTRG-ALOOEFSMSA-N
Reference
Alkaloids from the leaves ofStrychnos icaja Baill.
PubChem CID: 163082806
LOTUS: LTS0201120
SuperNatural Ⅲ: SN0210326-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos icaja | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 396.44300000000015
TPSA？: 82.61000000000001
MolLogP？: 0.8260000000000003
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|