(1S,2R,5S,6R,7R)-2-N-cyclohexyl-3-(2-methoxyethyl)-4-oxo-6-N-(4-phenoxyphenyl)-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
AlkaPlorer ID: AK459666
Synonym: None
IUPAC Name: (1S,2R,5S,6R,7R)-2-N-cyclohexyl-3-(2-methoxyethyl)-4-oxo-6-N-(4-phenoxyphenyl)-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-2,6-dicarboxamide
Structure
SMILES: COCCN1C(=O)[C@H]2[C@@H](C(=O)NC3=CC=C(OC4=CC=CC=C4)C=C3)[C@H]3C=C[C@@]2(O3)[C@@H]1C(=O)NC1CCCCC1
InChI: InChI=1S/C31H35N3O6/c1-38-19-18-34-27(29(36)33-20-8-4-2-5-9-20)31-17-16-24(40-31)25(26(31)30(34)37)28(35)32-21-12-14-23(15-13-21)39-22-10-6-3-7-11-22/h3,6-7,10-17,20,24-27H,2,4-5,8-9,18-19H2,1H3,(H,32,35)(H,33,36)/t24-,25+,26-,27+,31+/m1/s1
InChIKey: MRVPHPJGNCSACC-YQXAMQIPSA-N
Reference
New Briaranes from the Taiwanese Gorgonian <i>Junceella </i><i>j</i><i>uncea</i>
PubChem CID: 98180767
Source
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Properties Information
Molecule Weight: 545.636
TPSA？: 106.20000000000002
MolLogP？: 3.663300000000001
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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