Blasticidin A
AlkaPlorer ID: AK011978
Synonym: None
IUPAC Name: (3Z)-1-methyl-3-[(E,4S,6R)-1,8,9,11,13,15,17,19,21,23,25,26,27,28,29-pentadecahydroxy-2,4,6,10,14,16-hexamethyl-30-[(2R,3S,4S,5S,6S)-3,4,5,6-tetrahydroxy-6-[(2R)-2-hydroxydodecyl]oxan-2-yl]triacont-2-enylidene]pyrrolidine-2,4-dione
Structure
SMILES: CCCCCCCCCC[C@@H](O)C[C@]1(O)O[C@H](CC(O)C(O)C(O)C(O)C(O)CC(O)CC(O)CC(O)CC(O)C(C)C(O)C(C)C(O)CC(O)C(C)C(O)C(O)C[C@H](C)C[C@H](C)/C=C(C)/C(O)=C2\C(=O)CN(C)C2=O)[C@@H](O)[C@H](O)[C@@H]1O
InChI: InChI=1S/C58H107NO23/c1-9-10-11-12-13-14-15-16-17-35(60)27-58(81)56(79)55(78)53(76)46(82-58)26-44(69)52(75)54(77)51(74)43(68)24-38(63)22-36(61)21-37(62)23-39(64)32(5)49(72)33(6)40(65)25-41(66)34(7)50(73)42(67)20-30(3)18-29(2)19-31(4)48(71)47-45(70)28-59(8)57(47)80/h19,29-30,32-44,46,49-56,60-69,71-79,81H,9-18,20-28H2,1-8H3/b31-19+,48-47-/t29-,30+,32?,33?,34?,35+,36?,37?,38?,39?,40?,41?,42?,43?,44?,46+,49?,50?,51?,52?,53+,54?,55-,56-,58-/m0/s1
InChIKey: VVBSMETZVCGSHB-YOYVLXAYSA-N
Reference
Blasticidin A as an Inhibitor of Aflatoxin Production by Aspergillus parasiticus.
PubChem CID: 139586235
LOTUS: LTS0067515
{NPAtlas: NPA011311
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus parasiticus | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1186.4780000000003
TPSA？: 451.2100000000001
MolLogP？: -1.4082999999999757
Number of H-Donors: 20
Number of H-Acceptors: 23
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|