cavanine
AlkaPlorer ID: AK153668
Synonym: '', 'Cavanine'
IUPAC Name: (12R,26R)-5,19,20-trimethoxy-25-methyl-2,17-dioxa-10,25-diazaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(31),3(36),4,6,8,10,13,15,18(33),19,21,28(32),29,34-tetradecaene-4,12-diol
Structure
SMILES: COC1=CC2=CC=NC3=C2C(=C1O)OC1=CC=C(C=C1)C[C@@H]1C2=C(C=C(OC)C(OC)=C2OC2=CC=C(C=C2)[C@H]3O)CCN1C
InChI: InChI=1S/C36H34N2O7/c1-38-16-14-23-19-28(42-3)34(43-4)36-29(23)26(38)17-20-5-9-24(10-6-20)44-35-30-22(18-27(41-2)33(35)40)13-15-37-31(30)32(39)21-7-11-25(45-36)12-8-21/h5-13,15,18-19,26,32,39-40H,14,16-17H2,1-4H3/t26-,32-/m1/s1
InChIKey: RUJPHXSNWQFEMF-HVIPQOSHSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sciadotenia toxifera | Sciadotenia | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 606.6750000000002
TPSA？: 102.74
MolLogP？: 6.717600000000008
Number of H-Donors: 2
Number of H-Acceptors: 9
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|