3-[(3R,9S,14aS)-9-(hydroxymethyl)-1,4,7,10-tetraoxo-decahydropyrrolo[1,2-a]1,4,7,10-tetraazacyclododecan-3-yl]propanoic acid
AlkaPlorer ID: AK322438
Synonym: None
IUPAC Name: 3-[3-(hydroxymethyl)-2,5,8,11-tetraoxo-1,4,7,10-tetrazabicyclo[10.3.0]pentadecan-9-yl]propanoic acid
Structure
SMILES: O=C(O)CCC1N=C(O)C2CCCN2C(=O)C(CO)N=C(O)CN=C1O
InChI: InChI=1S/C15H22N4O7/c20-7-9-15(26)19-5-1-2-10(19)14(25)18-8(3-4-12(22)23)13(24)16-6-11(21)17-9/h8-10,20H,1-7H2,(H,16,24)(H,17,21)(H,18,25)(H,22,23)
InChIKey: HCPCZMCZJYSIAJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Suberites domuncula | Suberites | Suberitidae | Suberitida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 370.3620000000001
TPSA？: 175.61
MolLogP？: -0.5451999999999977
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|