Sciadoline
AlkaPlorer ID: AK118049
Synonym: ''
IUPAC Name: (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-tetradecaen-4-ol
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)C3)CCN1C
InChI: InChI=1S/C36H34N2O6/c1-38-16-14-24-20-30(41-3)34(42-4)36-32(24)28(38)18-22-7-11-25(12-8-22)43-35-31-23(19-29(40-2)33(35)39)13-15-37-27(31)17-21-5-9-26(44-36)10-6-21/h5-13,15,19-20,28,39H,14,16-18H2,1-4H3/t28-/m1/s1
InChIKey: OBXLLMHUGZIEJW-MUUNZHRXSA-N
Reference
Sciadenine, a New Bisbenzylisoquinolonen Alkaloid from Sciadotenia toxifera
PubChem CID: 101967114
LOTUS: LTS0034181
SuperNatural Ⅲ: SN0261221-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Sciadotenia toxifera | Sciadotenia | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 590.676
TPSA？: 82.51
MolLogP？: 7.226700000000008
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 10
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|