Fuscachelin B; 32-Amide
AlkaPlorer ID: AK298892
Synonym: Fuscachelin C
IUPAC Name: N-[1-[[2-[[2-[[1-amino-5-[[2-[[2-[[2-[[5-(diaminomethylideneamino)-2-[(2,3-dihydroxybenzoyl)amino]pentanoyl]amino]acetyl]amino]acetyl]amino]-3-hydroxypropanoyl]-hydroxyamino]-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-2,3-dihydroxybenzamide
Structure
SMILES: N=C(N)NCCCC(N=C(O)C1=CC=CC(O)=C1O)C(O)=NCC(O)=NCC(O)=NC(CCCN(O)C(=O)C(CO)N=C(O)CN=C(O)CN=C(O)C(CCCNC(=N)N)N=C(O)C1=CC=CC(O)=C1O)C(=N)O
InChI: InChI=1S/C42H62N16O16/c43-35(68)23(54-31(64)18-50-29(62)16-52-38(71)24(8-3-13-48-41(44)45)56-36(69)21-6-1-11-27(60)33(21)66)10-5-15-58(74)40(73)26(20-59)55-32(65)19-51-30(63)17-53-39(72)25(9-4-14-49-42(46)47)57-37(70)22-7-2-12-28(61)34(22)67/h1-2,6-7,11-12,23-26,59-61,66-67,74H,3-5,8-10,13-20H2,(H2,43,68)(H,50,62)(H,51,63)(H,52,71)(H,53,72)(H,54,64)(H,55,65)(H,56,69)(H,57,70)(H4,44,45,48)(H4,46,47,49)
InChIKey: MMPMJMJQRDAXEQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Thermobifida fusca | Thermobifida | Nocardiopsaceae | Streptosporangiales | Actinomycetes | Actinomycetota | None | Bacteria |
Properties Information
Molecule Weight: 1047.054
TPSA？: 570.2900000000002
MolLogP？: 0.0839100000000084
Number of H-Donors: 22
Number of H-Acceptors: 18
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|