Grossamide; Z-Isomer
AlkaPlorer ID: AK299678
Synonym: Tataramide B, (Z)-Grossamide
IUPAC Name: 2-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-5-[(Z)-3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide
Structure
SMILES: COC1=CC(C2OC3=C(OC)C=C(/C=C\C(=O)NCCC4=CC=C(O)C=C4)C=C3C2C(=O)NCCC2=CC=C(O)C=C2)=CC=C1O
InChI: InChI=1S/C36H36N2O8/c1-44-30-21-25(8-13-29(30)41)34-33(36(43)38-18-16-23-5-11-27(40)12-6-23)28-19-24(20-31(45-2)35(28)46-34)7-14-32(42)37-17-15-22-3-9-26(39)10-4-22/h3-14,19-21,33-34,39-41H,15-18H2,1-2H3,(H,37,42)(H,38,43)/b14-7-
InChIKey: DROXVBRNXCRUHP-AUWJEWJLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Acorus tatarinowii | Acorus | Acoraceae | Acorales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Withania somnifera | Withania | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Solanum tuberosum | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 624.6900000000004
TPSA？: 146.58
MolLogP？: 4.768900000000005
Number of H-Donors: 5
Number of H-Acceptors: 8
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|