Vertihemiptellide B
AlkaPlorer ID: AK032837
Synonym: None
IUPAC Name: (1R,4R,7R,10R)-4,10-dibenzyl-1,7-bis(hydroxymethyl)-5-methyl-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)(N=C1O)SS2
InChI: InChI=1S/C25H26N4O6S4/c1-29-21(35)24(15-31)28-20(34)25(29,13-17-10-6-3-7-11-17)39-37-23(14-30)19(33)26-22(36-38-24,18(32)27-23)12-16-8-4-2-5-9-16/h2-11,30-31H,12-15H2,1H3,(H,26,33)(H,27,32)(H,28,34)/t22-,23-,24-,25-/m1/s1
InChIKey: ZQJZMGLUHHLCJH-ZGFBMJKBSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Verticillium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 606.7730000000003
TPSA？: 158.54
MolLogP？: 3.3731
Number of H-Donors: 5
Number of H-Acceptors: 10
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|