FR901451
AlkaPlorer ID: AK326257
Synonym: None
IUPAC Name: 24-[(2-amino-3-hydroxybutanoyl)amino]-15-benzyl-32-(1H-indol-3-ylmethyl)-25-methyl-21-(2-methylpropyl)-3,8,14,17,20,23,27,30,33,35,39,46-dodecaoxo-4,26-dioxa-7,13,16,19,22,31,34,36,40,45-decazatetracyclo[16.16.10.26,29.09,13]hexatetracontane-37-carboxylic acid
Structure
SMILES: CC(C)CC1N=C(O)C(N=C(O)C(N)C(C)O)C(C)OC(=O)CC2N=C(O)C3COC(=O)CC(N=C(O)C(CC4=CNC5=CC=CC=C45)N=C2O)C(O)=NC(C(=O)O)CC(O)=NCCCCC(N=C1O)C(O)=NC(CC1=CC=CC=C1)C(=O)N1CCCC1C(O)=N3
InChI: InChI=1S/C60H79N13O18/c1-29(2)21-37-51(79)64-36-17-10-11-19-62-45(75)24-42(60(88)89)70-54(82)39-25-46(76)90-28-43(71-56(84)44-18-12-20-73(44)59(87)41(69-50(36)78)22-32-13-6-5-7-14-32)55(83)67-40(26-47(77)91-31(4)49(58(86)68-37)72-57(85)48(61)30(3)74)53(81)65-38(52(80)66-39)23-33-27-63-35-16-9-8-15-34(33)35/h5-9,13-16,27,29-31,36-44,48-49,63,74H,10-12,17-26,28,61H2,1-4H3,(H,62,75)(H,64,79)(H,65,81)(H,66,80)(H,67,83)(H,68,86)(H,69,78)(H,70,82)(H,71,84)(H,72,85)(H,88,89)
InChIKey: IGCVJULNJMQDMD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Flexibacter sp. | Flexibacter | Flexibacteraceae | Cytophagales | Cytophagia | Bacteroidota | None | Bacteria |
Properties Information
Molecule Weight: 1270.3650000000002
TPSA？: 498.1500000000002
MolLogP？: 4.521600000000017
Number of H-Donors: 14
Number of H-Acceptors: 18
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|