Not named
AlkaPlorer ID: AK055463
Synonym: None
IUPAC Name: N-[(2S,3R)-1-[[2-[[(2S)-1-[[(3S,6S,9S,12S)-3,6-bis(3-amino-3-oxopropyl)-9-(1H-imidazol-5-ylmethyl)-2,5,8,11-tetraoxo-1-oxa-4,7,10-triazacyclotridec-12-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-hydroxy-1-oxobutan-2-yl]dodecanamide
Structure
SMILES: CCCCCCCCCCCC(O)=N[C@H](C(O)=NCC(O)=N[C@@H](C)C(O)=N[C@H]1COC(=O)[C@H](CCC(=N)O)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H](CC2=CN=CN2)N=C1O)[C@@H](C)O
InChI: InChI=1S/C40H65N11O12/c1-4-5-6-7-8-9-10-11-12-13-32(55)51-34(24(3)52)39(61)44-20-33(56)46-23(2)35(57)50-29-21-63-40(62)27(15-17-31(42)54)48-36(58)26(14-16-30(41)53)47-37(59)28(49-38(29)60)18-25-19-43-22-45-25/h19,22-24,26-29,34,52H,4-18,20-21H2,1-3H3,(H2,41,53)(H2,42,54)(H,43,45)(H,44,61)(H,46,56)(H,47,59)(H,48,58)(H,49,60)(H,50,57)(H,51,55)/t23-,24+,26-,27-,28-,29-,34-/m0/s1
InChIKey: OWDOAIJHHSFXIW-VCJCTMQHSA-N
Reference
Kurstakins: A New Class of Lipopeptides Isolated from <i>Bacillus </i><i>t</i><i>huringiensis</i>
PubChem CID: 10724375
LOTUS: LTS0134704
{NPAtlas: NPA017294
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Bacillus thuringiensis | Bacillus | Bacillaceae | Bacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 892.0250000000001
TPSA？: 391.50000000000006
MolLogP？: 5.368640000000007
Number of H-Donors: 13
Number of H-Acceptors: 13
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|