(2S)-2-{[(20R)-17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1,3,8,10,12,14(19),15,17-octaen-20-yl]methyl}-7-methoxy-2,6-dimethylpyrano[3,2-c]quinolin-5-one
AlkaPlorer ID: AK111407
Synonym: None
IUPAC Name: (2S)-2-[[(13R)-1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridin-13-yl]methyl]-7-methoxy-2,6-dimethylpyrano[3,2-c]quinolin-5-one
Structure
SMILES: COC1=CC=C2C3=CC=C4C=C5OCOC5=CC4=C3N(C)[C@H](C[C@@]3(C)C=CC4=C(O3)C3=CC=CC(OC)=C3N(C)C4=O)C2=C1OC
InChI: InChI=1S/C37H34N2O7/c1-37(15-14-24-34(46-37)23-8-7-9-27(41-4)33(23)39(3)36(24)40)18-26-31-21(12-13-28(42-5)35(31)43-6)22-11-10-20-16-29-30(45-19-44-29)17-25(20)32(22)38(26)2/h7-17,26H,18-19H2,1-6H3/t26-,37-/m1/s1
InChIKey: NUVWARFQHKLGOS-NGXVIIRPSA-N
Reference
Alkaloids from Zanthoxylum simulans
PubChem CID: 102236946
LOTUS: LTS0016683
SuperNatural Ⅲ: SN0255867-02
NPASS: NPC186237
Source
Properties Information
Molecule Weight: 618.6860000000001
TPSA？: 80.62
MolLogP？: 6.858700000000007
Number of H-Donors: 0
Number of H-Acceptors: 9
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|