Bengamide Y
AlkaPlorer ID: AK014747
Synonym: ''
IUPAC Name: (E,2R,3R,4S,5R)-3,4,5-trihydroxy-N-[(3S,6S)-6-hydroxy-2-oxoazepan-3-yl]-2-methoxy-8-methylnon-6-enamide
Structure
SMILES: CO[C@@H](C(O)=N[C@H]1CC[C@H](O)CN=C1O)[C@H](O)[C@@H](O)[C@H](O)/C=C/C(C)C
InChI: InChI=1S/C17H30N2O7/c1-9(2)4-7-12(21)13(22)14(23)15(26-3)17(25)19-11-6-5-10(20)8-18-16(11)24/h4,7,9-15,20-23H,5-6,8H2,1-3H3,(H,18,24)(H,19,25)/b7-4+/t10-,11-,12+,13-,14+,15+/m0/s1
InChIKey: QUZZOPFZTPGKCS-AITVLSCUSA-N
Reference
Cytotoxic Metabolites from an Australian Collection of the Sponge <i>Jaspis</i> Species
PubChem CID: 6476094
LOTUS: LTS0139114
SuperNatural Ⅲ: SN0315958-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | None | Ancorinidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 374.4340000000001
TPSA？: 155.32999999999998
MolLogP？: -0.2673999999999985
Number of H-Donors: 6
Number of H-Acceptors: 7
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|