16-hydroxy-17-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-1(21),2(10),3,8,15,17,19-heptaen-14-one
AlkaPlorer ID: AK101797
Synonym: None
IUPAC Name: 16-hydroxy-17-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaen-14-one
Structure
SMILES: COC1=CC=C2C=C3C4=CC5=C(C=C4CCN3C(=O)C2=C1O)OCO5
InChI: InChI=1S/C19H15NO5/c1-23-14-3-2-11-6-13-12-8-16-15(24-9-25-16)7-10(12)4-5-20(13)19(22)17(11)18(14)21/h2-3,6-8,21H,4-5,9H2,1H3
InChIKey: CWKBTNZNPCPAPB-UHFFFAOYSA-N
Reference
Berberis alkaloids. XVII. Investigation of the alkaloids of Berberis heteropoda
PubChem CID: 5384082
CAS: 29580-82-3
LOTUS: LTS0252946
SuperNatural Ⅲ: SN0057389
COCONUT: CNP0275376
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Arcangelisia gusanlung | Arcangelisia | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 337.3310000000001
TPSA？: 69.92
MolLogP？: 2.6675000000000004
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|