9,10,25-trimethoxy-15-methyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.2³,?.2¹?,²¹.1?,¹².0²?,³¹.0¹?,³?]heptatriaconta-1(31),3,5,8,10,12(35),18,20,24,26,33,36-dodecaen-32-one
AlkaPlorer ID: AK122551
Synonym: None
IUPAC Name: (16R)-9,10,25-trimethoxy-15-methyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.218,21.18,12.027,31.016,35]heptatriaconta-1(30),3(37),4,6(36),8(35),9,11,18,20,24,26,31,33-tridecaen-32-ol
Structure
SMILES: COC1=C2OCC3=CC=C(C=C3)C[C@@H]3C4=C(OC5=CC=C(C=C5)CC5=C(C2=O)C(=C1)CCN5)C(OC)=C(OC)C=C4CCN3C
InChI: InChI=1S/C37H38N2O6/c1-39-16-14-26-20-31(42-3)36(43-4)37-33(26)29(39)18-23-5-7-24(8-6-23)21-44-35-30(41-2)19-25-13-15-38-28(32(25)34(35)40)17-22-9-11-27(45-37)12-10-22/h5-12,19-20,29,38H,13-18,21H2,1-4H3/t29-/m1/s1
InChIKey: VPZDOTDOKSWSKL-GDLZYMKVSA-N
Reference
NPASS: NPC263970
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stephania tetrandra | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Aristolochia kaempferi | Aristolochia | Aristolochiaceae | Piperales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Cissampelos pareira | Cissampelos | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 606.719
TPSA？: 78.49000000000001
MolLogP？: 5.955000000000006
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|