Vertihemiptellide A
AlkaPlorer ID: AK056199
Synonym: None
IUPAC Name: (1R,4R,7R,10R)-4,10-dibenzyl-1,7-bis(hydroxymethyl)-5,11-dimethyl-2,3,8,9-tetrathia-5,11,13,15-tetrazatricyclo[8.2.2.24,7]hexadecane-6,12,14,16-tetrone
Structure
SMILES: CN1C(=O)[C@]2(CO)N=C(O)[C@@]1(CC1=CC=CC=C1)SS[C@@]1(CO)N=C(O)[C@@](CC3=CC=CC=C3)(SS2)N(C)C1=O
InChI: InChI=1S/C26H28N4O6S4/c1-29-21(35)23(15-31)27-19(33)25(29,13-17-9-5-3-6-10-17)39-38-24(16-32)22(36)30(2)26(40-37-23,20(34)28-24)14-18-11-7-4-8-12-18/h3-12,31-32H,13-16H2,1-2H3,(H,27,33)(H,28,34)/t23-,24-,25-,26-/m1/s1
InChIKey: KXIZPSCHKWRWDA-VEYUFSJPSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Verticillium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 620.8000000000002
TPSA？: 146.26000000000002
MolLogP？: 2.875000000000001
Number of H-Donors: 4
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|