None
AlkaPlorer ID: AK324107
Synonym: None
IUPAC Name: None
Structure
SMILES: CC[C@@](C)(N=C(O)C(C)(C)N=C(O)[C@@H](N=C(O)[C@@H]1CCCN1C(=O)C(C)(C)N=C(O)[C@H](CC(C)C)N=C(O)CN=C(O)C(C)(C)N=C(O)[C@@H](N=C(O)C(C)(C)N=C(O)[C@H](CCC(=N)O)N=C(O)C(C)(C)N=C(O)C(C)(C)N=C(O)[C@H](C)N=C(O)C(C)(C)N=C(O)[C@H](C)N=C(O)C(C)(C)N=C(C)O)C(C)C)C(C)C)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@@H](CCC(=N)O)C(O)=N[C@H](CO)CC1=CC=CC=C1
InChI: InChI=1S/C92H153N23O24/c1-28-92(27,82(138)103-56(37-40-61(94)119)69(125)101-55(36-39-60(93)118)68(124)99-54(46-116)44-53-33-30-29-31-34-53)114-81(137)90(23,24)112-73(129)64(48(4)5)104-72(128)59-35-32-42-115(59)83(139)91(25,26)110-71(127)58(43-47(2)3)100-63(121)45-96-75(131)84(11,12)111-74(130)65(49(6)7)105-79(135)87(17,18)109-70(126)57(38-41-62(95)120)102-78(134)88(19,20)113-80(136)89(21,22)108-67(123)51(9)98-77(133)86(15,16)107-66(122)50(8)97-76(132)85(13,14)106-52(10)117/h29-31,33-34,47-51,54-59,64-65,116H,28,32,35-46H2,1-27H3,(H2,93,118)(H2,94,119)(H2,95,120)(H,96,131)(H,97,132)(H,98,133)(H,99,124)(H,100,121)(H,101,125)(H,102,134)(H,103,138)(H,104,128)(H,105,135)(H,106,117)(H,107,122)(H,108,123)(H,109,126)(H,110,127)(H,111,130)(H,112,129)(H,113,136)(H,114,137)/t50-,51-,54-,55-,56-,57-,58-,59-,64-,65-,92+/m0/s1
InChIKey: HPOJZMVSPXDYJX-RDWGHJIBSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Trichoderma longibrachiatum | Trichoderma | Hypocreaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 1965.3729999999991
TPSA？: 791.9900000000004
MolLogP？: 14.465009999999992
Number of H-Donors: 26
Number of H-Acceptors: 24
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Acholeplasma laidlawii | Acholeplasma laidlawii | MIC | 780.0 | nM | 10.1021/np000240s |
| Acholeplasma laidlawii | Acholeplasma laidlawii | MLC | 3.12 | uM | 10.1021/np000240s |
| Mycoplasma mycoides subsp. mycoides SC | Mycoplasma mycoides subsp. mycoides SC | MIC | 6250.0 | nM | 10.1021/np000240s |
| Mycoplasma mycoides subsp. mycoides SC | Mycoplasma mycoides subsp. mycoides SC | MLC | 3.12 | uM | 10.1021/np000240s |
| Mycoplasmoides gallisepticum | Mycoplasmoides gallisepticum | MIC | 6250.0 | nM | 10.1021/np000240s |
| Mycoplasmoides gallisepticum | Mycoplasmoides gallisepticum | MLC | 3.12 | uM | 10.1021/np000240s |
| Spiroplasma apis | Spiroplasma apis | MIC | 6250.0 | nM | 10.1021/np000240s |
| Spiroplasma apis | Spiroplasma apis | MLC | 3.12 | uM | 10.1021/np000240s |
| Spiroplasma citri | Spiroplasma citri | MIC | 3120.0 | nM | 10.1021/np000240s |
| Spiroplasma citri | Spiroplasma citri | MLC | 3.12 | uM | 10.1021/np000240s |
| Spiroplasma floricola | Spiroplasma floricola | MIC | 6250.0 | nM | 10.1021/np000240s |
| Spiroplasma floricola | Spiroplasma floricola | MLC | 3.12 | uM | 10.1021/np000240s |
| None | No relevant target | Ratio | 4545.0 | None | 10.1021/np000240s |