![N,N',N''-(NITRILOTRI-2,1-ETHANEDIYL)-TRIS-[N'''-TRICYCLO-[3.3.1.1(3,7)]-DEC-1-YLUREA]](/api/spectrum/2XULan365jH/structure.png?h=300&w=458 "N,N',N''-(NITRILOTRI-2,1-ETHANEDIYL)-TRIS-[N'''-TRICYCLO-[3.3.1.1(3,7)]-DEC-1-YLUREA]")
| SpectraBase Compound ID | 17YVBONuNfO |
|---|---|
| InChI | InChI=1S/C39H63N7S3/c47-34(43-37-16-25-7-26(17-37)9-27(8-25)18-37)40-1-4-46(5-2-41-35(48)44-38-19-28-10-29(20-38)12-30(11-28)21-38)6-3-42-36(49)45-39-22-31-13-32(23-39)15-33(14-31)24-39/h25-33H,1-24H2,(H2,40,43,47)(H2,41,44,48)(H2,42,45,49)/t25-,26+,27-,28-,29+,30-,31-,32+,33-,37-,38-,39- |
| InChIKey | OQBWVASRBXZNBT-NSTNPIPRSA-N |
| Mol Weight | 726.2 g/mol |
| Molecular Formula | C39H63N7S3 |
| Exact Mass | 725.430709 g/mol |
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| SpectraBase Spectrum ID | 2XULan365jH |
|---|---|
| Name | N,N',N''-(NITRILOTRI-2,1-ETHANEDIYL)-TRIS-[N'''-TRICYCLO-[3.3.1.1(3,7)]-DEC-1-YLUREA] |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H63N7S3 |
| InChI | InChI=1S/C39H63N7S3/c47-34(43-37-16-25-7-26(17-37)9-27(8-25)18-37)40-1-4-46(5-2-41-35(48)44-38-19-28-10-29(20-38)12-30(11-28)21-38)6-3-42-36(49)45-39-22-31-13-32(23-39)15-33(14-31)24-39/h25-33H,1-24H2,(H2,40,43,47)(H2,41,44,48)(H2,42,45,49)/t25-,26+,27-,28-,29+,30-,31-,32+,33-,37-,38-,39- |
| InChIKey | OQBWVASRBXZNBT-NSTNPIPRSA-N |
| Literature Reference Author | N.MIBU,K.YOKOMIZO,W.UCHIDA,S.TAKEMURA,J.ZHOU,H.AKI,T.MIYATA, K.SUMOTO |
| Literature Reference Citation | CHEM.PHARM.BULL.,60,408(2012) |
| Literature Reference DOI | 10.1248/cpb.60.408 |
| Molecular Weight | 726.156 g/mol |
| Source File Reference | UWBT4333 |