Trikoningin-KA-V
AlkaPlorer ID: AK037554
Synonym: None
IUPAC Name: None
Structure
SMILES: CCC(C)C(N=C(O)C(C)(C)N=C(O)C(C)N=C(O)CN=C(O)C(C)(C)N=C(C)O)C(O)=NC(CCC(=N)O)C(O)=NC(C)(C)C(O)=NC(C)(C)C(O)=NC(C)(C)C(O)=NC(CO)C(O)=NC(CC(C)C)C(O)=NC(C)(C)C(=O)N1CCCC1C(O)=NC(C(O)=NC(C)(C)C(O)=NC(C(O)=NC(CCC(=N)O)C(O)=NC(CCC(=N)O)C(O)=NC(CO)CC(C)C)C(C)CC)C(C)C
InChI: InChI=1S/C87H152N22O24/c1-27-46(9)62(71(124)95-52(32-35-58(89)114)66(119)94-51(31-34-57(88)113)65(118)93-50(41-110)38-43(3)4)101-77(130)83(17,18)106-73(126)61(45(7)8)99-70(123)56-30-29-37-109(56)80(133)87(25,26)105-69(122)54(39-44(5)6)97-67(120)55(42-111)98-75(128)84(19,20)107-79(132)86(23,24)108-78(131)85(21,22)104-68(121)53(33-36-59(90)115)96-72(125)63(47(10)28-2)100-76(129)82(15,16)103-64(117)48(11)92-60(116)40-91-74(127)81(13,14)102-49(12)112/h43-48,50-56,61-63,110-111H,27-42H2,1-26H3,(H2,88,113)(H2,89,114)(H2,90,115)(H,91,127)(H,92,116)(H,93,118)(H,94,119)(H,95,124)(H,96,125)(H,97,120)(H,98,128)(H,99,123)(H,100,129)(H,101,130)(H,102,112)(H,103,117)(H,104,121)(H,105,122)(H,106,126)(H,107,132)(H,108,131)
InChIKey: ULADORNVGXTXBP-UHFFFAOYSA-N
Reference
Structural elucidation of trikoningins KA and KB, peptaibols from Trichoderma koningii
PubChem CID: 139583600
LOTUS: LTS0114078
COCONUT: CNP0379796
{NPAtlas: NPA001821
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trichoderma koningii | Trichoderma | Hypocreaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1890.303
TPSA？: 779.6300000000005
MolLogP？: 13.141809999999994
Number of H-Donors: 26
Number of H-Acceptors: 24
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|