FJ120DPA
AlkaPlorer ID: AK122748
Synonym: None
IUPAC Name: N-[(3R,6S,7R,10S,13S,16S,19S)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-7,10,14-trimethyl-2,5,9,12,15,18-hexaoxo-3-propan-2-yl-8-oxa-1,4,11,14,17-pentazabicyclo[17.3.0]docosan-6-yl]acetamide
Structure
SMILES: CC(O)=N[C@@H]1C(O)=N[C@H](C(C)C)C(=O)N2CCC[C@H]2C(O)=N[C@@H](CC2=CC=C(O)C=C2)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(O)=N[C@@H](C)C(=O)O[C@@H]1C
InChI: InChI=1S/C38H50N6O9/c1-21(2)31-37(51)44-18-10-13-29(44)33(47)41-28(19-26-14-16-27(46)17-15-26)36(50)43(6)30(20-25-11-8-7-9-12-25)34(48)39-22(3)38(52)53-23(4)32(35(49)42-31)40-24(5)45/h7-9,11-12,14-17,21-23,28-32,46H,10,13,18-20H2,1-6H3,(H,39,48)(H,40,45)(H,41,47)(H,42,49)/t22-,23+,28-,29-,30-,31+,32-/m0/s1
InChIKey: XXGGUYOBOGKLEA-SDUBJODWSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus ochraceopetaliformis | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 734.8510000000001
TPSA？: 217.51
MolLogP？: 3.9369000000000014
Number of H-Donors: 5
Number of H-Acceptors: 9
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|