Virotoxin; Viroisin
AlkaPlorer ID: AK245382
Synonym: None
IUPAC Name: 12-[2,3-dihydroxy-2-(hydroxymethyl)propyl]-22,23-dihydroxy-6-(1-hydroxyethyl)-3-(hydroxymethyl)-18-methyl-15-[(2-methylsulfonyl-1H-indol-3-yl)methyl]-9-propan-2-yl-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone
Structure
SMILES: CC1N=C(O)C2C(O)C(O)CN2C(=O)C(CO)N=C(O)C(C(C)O)N=C(O)C(C(C)C)N=C(O)C(CC(O)(CO)CO)N=C(O)C(CC2=C(S(C)(=O)=O)NC3=CC=CC=C23)N=C1O
InChI: InChI=1S/C38H56N8O16S/c1-16(2)26-33(56)45-27(18(4)50)34(57)42-24(13-47)37(59)46-12-25(51)29(52)28(46)35(58)39-17(3)30(53)40-22(31(54)41-23(32(55)44-26)11-38(60,14-48)15-49)10-20-19-8-6-7-9-21(19)43-36(20)63(5,61)62/h6-9,16-18,22-29,43,47-52,60H,10-15H2,1-5H3,(H,39,58)(H,40,53)(H,41,54)(H,42,57)(H,44,55)(H,45,56)
InChIKey: JDQNYCQBLILOAN-UHFFFAOYSA-N
Reference
Toxicity of peptides of Amanita virosa mushrooms in mice
PubChem CID: 119538
LOTUS: LTS0097710
COCONUT: CNP0154426
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amanita virosa | Amanita | Amanitaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 912.973
TPSA？: 407.39
MolLogP？: -1.834499999999986
Number of H-Donors: 14
Number of H-Acceptors: 16
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|