Thalifortine
AlkaPlorer ID: AK056452
Synonym: ''
IUPAC Name: (12S,25S)-4,5,31-trimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,14(36),15,17(35),19,21,23(34),29,32-dodecaen-20-ol
Structure
SMILES: COC1=C2C=C3C(=C1)CCN(C)[C@H]3CC1=CC=C(O)C(=C1)OC1=CC=C(C=C1)C[C@H]1C3=CC(OC)=C(OC)C(=C3CCN1C)O2
InChI: InChI=1S/C37H40N2O6/c1-38-14-12-24-19-33(41-3)34-20-27(24)29(38)17-23-8-11-31(40)32(18-23)44-25-9-6-22(7-10-25)16-30-28-21-35(42-4)37(43-5)36(45-34)26(28)13-15-39(30)2/h6-11,18-21,29-30,40H,12-17H2,1-5H3/t29-,30-/m0/s1
InChIKey: KHNITWQNJMUVRC-KYJUHHDHSA-N
Reference
PubChem CID: 181168
CAS: 58092-24-3
LOTUS: LTS0056704
SuperNatural Ⅲ: SN0185778-02
NPASS: NPC105574
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thalictrum cultratum | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Thalictrum minus | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 608.735
TPSA？: 72.86000000000001
MolLogP？: 6.859400000000009
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|