8-Hydroxy-4-(hydroxymethyl)-9-[8-hydroxy-5-methyl-4,7-bis(methylsulfanyl)-3,6-dioxo-4-propan-2-yl-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-trien-9-yl]-5,16-dimethyl-4,7-bis(methylsulfanyl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
AlkaPlorer ID: AK322173
Synonym: None
IUPAC Name: 8-hydroxy-4-(hydroxymethyl)-9-[8-hydroxy-5-methyl-4,7-bis(methylsulfanyl)-3,6-dioxo-4-propan-2-yl-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-trien-9-yl]-5,16-dimethyl-4,7-bis(methylsulfanyl)-2,5,16-triazatetracyclo[7.7.0.02,7.010,15]hexadeca-10,12,14-triene-3,6-dione
Structure
SMILES: CSC1(CO)C(=O)N2C3N(C)C4=CC=CC=C4C3(C34C5=CC=CC=C5NC3N3C(=O)C(SC)(C(C)C)N(C)C(=O)C3(SC)C4O)C(O)C2(SC)C(=O)N1C
InChI: InChI=1S/C37H46N6O7S4/c1-19(2)35(52-7)31(50)42-26-33(20-14-10-12-16-22(20)38-26,24(45)36(42,53-8)30(49)41(35)5)34-21-15-11-13-17-23(21)39(3)27(34)43-28(47)32(18-44,51-6)40(4)29(48)37(43,54-9)25(34)46/h10-17,19,24-27,38,44-46H,18H2,1-9H3
InChIKey: ZHVYBACNVPPTJZ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Preussia typharum | Preussia | Sporormiaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 815.0780000000001
TPSA？: 157.20000000000002
MolLogP？: 1.625600000000001
Number of H-Donors: 4
Number of H-Acceptors: 13
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|