(12S,26R)-4,5,17,31-tetramethoxy-11,27-dimethyl-2,19,33,35-tetraoxa-11,27-diazaoctacyclo[24.10.1.1¹⁴,¹⁸.1²⁰,²⁴.0³,⁸.0⁷,¹².0³⁰,³⁷.0³²,³⁶]nonatriaconta-1(37),3,5,7,14,16,18(39),20(38),21,23,30,32(36)-dodecaene
AlkaPlorer ID: AK319196
Synonym: None
IUPAC Name: (12S,26S)-4,5,17,31-tetramethoxy-11,27-dimethyl-2,19,33,35-tetraoxa-11,27-diazaoctacyclo[24.10.1.114,18.120,24.03,8.07,12.030,37.032,36]nonatriaconta-1(36),3(8),4,6,14(39),15,17,20,22,24(38),30(37),31-dodecaene
Structure
SMILES: COC1=CC=C2C=C1OC1=CC(=CC=C1)C[C@H]1C3=C(OC4=C5CCN(C)[C@@H](C2)C5=CC(OC)=C4OC)C2=C(OCO2)C(OC)=C3CCN1C
InChI: InChI=1S/C39H42N2O8/c1-40-14-12-25-27-20-32(43-4)36(45-6)35(25)49-37-33-26(34(44-5)38-39(37)47-21-46-38)13-15-41(2)29(33)18-22-8-7-9-24(16-22)48-31-19-23(17-28(27)40)10-11-30(31)42-3/h7-11,16,19-20,28-29H,12-15,17-18,21H2,1-6H3/t28-,29-/m0/s1
InChIKey: VVTMSPVWECSHQM-VMPREFPWSA-N
Reference
New dimeric aporphine-benzylisoquinoline alkaloids from Thalictrum faberi
PubChem CID: 5321901
LOTUS: LTS0191572
NPASS: NPC220268
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thalictrum minus | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Thalictrum foliolosum | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Thalictrum foetidum | Thalictrum | Ranunculaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 666.7710000000001
TPSA？: 80.32000000000001
MolLogP？: 6.891100000000007
Number of H-Donors: 0
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|