| SpectraBase Spectrum ID |
4gYNrPTW6KH |
| Name |
1,4,7,10,13-Pentaoxa-16-azacyclooctadecane, 16-[[[5-[4,5-dihydro-4-(methoxymethyl)-5-phenyl-2-oxazolyl]-2-pyridinyl]methoxy]acetyl]-, (4S-trans)- |
| CAS Registry Number |
98704-90-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H43N3O9 |
| InChI |
InChI=1S/C31H43N3O9/c1-36-23-28-30(25-5-3-2-4-6-25)43-31(33-28)26-7-8-27(32-21-26)22-42-24-29(35)34-9-11-37-13-15-39-17-19-41-20-18-40-16-14-38-12-10-34/h2-8,21,28,30H,9-20,22-24H2,1H3/t28-,30-/m0/s1 |
| InChIKey |
IVCJIMINJVEHNQ-JDXGNMNLSA-N |
| Molecular Weight |
601.697 g/mol |
| SMILES |
C1(=N[C@@](COC)([C@@](O1)(c1ccccc1)[H])[H])c1cnc(cc1)COCC(N1CCOCCOCCOCCOCCOCC1)=O |
| SPLASH |
splash10-000i-0009000000-bc830bfac91e73b0bdaa |
| Source of Spectrum |
J-50-4244-24 |
| Synonyms |
16-[({5-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl}methoxy)acetyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
N-((4'-(2''-aza-3''-methoxymethyl-4''-phenyl-5''-oxa-cyclopentan-1''-enyl)-2'-pyrridinyl)-methoxymethylcarbonyl)-[18]azacrown |
| Wiley ID |
1410231 |
![1,4,7,10,13-Pentaoxa-16-azacyclooctadecane, 16-[[[5-[4,5-dihydro-4-(methoxymethyl)-5-phenyl-2-oxazolyl]-2-pyridinyl]methoxy]acetyl]-, (4S-trans)-](/api/spectrum/4gYNrPTW6KH/structure.png?h=300&w=458 "1,4,7,10,13-Pentaoxa-16-azacyclooctadecane, 16-[[[5-[4,5-dihydro-4-(methoxymethyl)-5-phenyl-2-oxazolyl]-2-pyridinyl]methoxy]acetyl]-, (4S-trans)-")
