None
AlkaPlorer ID: AK324250
Synonym: None
IUPAC Name: None
Structure
SMILES: CC(C)CCCC/C=C/C=C\C(O)=N[C@@H](CC(=O)O)C(O)=N[C@@H]1C(O)=N[C@H](C2=CC=C(O)C=C2)C(O)=N[C@H](CCCN)C(O)=N[C@H]([C@@H](C)O)C(O)=N[C@@H](C2=CC=C(O)C=C2)C(O)=N[C@H](C2=CC=C(O)C=C2)C(O)=N[C@@H]([C@H](C)O)C(O)=N[C@@H](CCCNC(=N)O)C(O)=NC(CC2CNC(=N)N2)C(O)=N[C@@H](C2=CC=C(O)C=C2)C(O)=N[C@H](CO)C(O)=N[C@@H](C2=CC(Cl)=C(O)C(Cl)=C2)C(O)=NCC(O)=N[C@@H](CC2CNC(=N)N2)C(O)=N[C@H](C)C(O)=N[C@@H](C2=CC=C(O)C=C2)C(=O)O[C@@H]1C
InChI: InChI=1S/C107H138Cl2N26O31/c1-50(2)15-11-9-7-8-10-12-18-76(144)121-74(45-78(146)147)94(154)129-81-54(6)166-104(164)87(59-27-37-67(143)38-28-59)135-89(149)51(3)118-92(152)72(43-61-46-116-105(111)119-61)122-77(145)48-115-96(156)86(60-41-68(108)88(148)69(109)42-60)131-95(155)75(49-136)126-101(161)82(55-19-29-63(139)30-20-55)130-93(153)73(44-62-47-117-106(112)120-62)125-90(150)71(17-14-40-114-107(113)165)123-97(157)79(52(4)137)128-102(162)84(57-23-33-65(141)34-24-57)134-103(163)85(58-25-35-66(142)36-26-58)132-98(158)80(53(5)138)127-91(151)70(16-13-39-110)124-100(160)83(133-99(81)159)56-21-31-64(140)32-22-56/h8,10,12,18-38,41-42,50-54,61-62,70-75,79-87,136-143,148H,7,9,11,13-17,39-40,43-49,110H2,1-6H3,(H,115,156)(H,118,152)(H,121,144)(H,122,145)(H,123,157)(H,124,160)(H,125,150)(H,126,161)(H,127,151)(H,128,162)(H,129,154)(H,130,153)(H,131,155)(H,132,158)(H,133,159)(H,134,163)(H,135,149)(H,146,147)(H3,111,116,119)(H3,112,117,120)(H3,113,114,165)/b10-8+,18-12-/t51-,52+,53-,54-,61?,62?,70-,71+,72+,73?,74+,75-,79+,80-,81+,82+,83-,84-,85+,86+,87+/m1/s1
InChIKey: IPZGNBNNEDCXBK-QTWSDDGOSA-N
Reference
NPASS: NPC486917
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Streptomyces fungicidicus | Streptomyces | Streptomycetaceae | Kitasatosporales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 2355.337999999998
TPSA?: 977.6500000000004
MolLogP?: 10.817710000000012
Number of H-Donors: 37
Number of H-Acceptors: 33
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Staphylococcus aureus | Staphylococcus aureus | MIC | None | None | 10.1021/np900710q |
