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CHEBI:44367 - 3-{[(3R,4S,5S,6R)-7-benzyl-4,5-dihydroxy-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepan-2-yl]methyl}-N-methylbenzamide S,S-dioxide
| Formula | C34H37N3O7S |
| Net Charge | 0 |
| Average Mass | 631.751 |
| Monoisotopic Mass | 631.23522 |
| SMILES | [H]O[C@]1([H])[C@@]([H])(O[H])[C@@]([H])(C([H])([H])Oc2c([H])c([H])c([H])c([H])c2[H])N(C([H])([H])c2c([H])c([H])c([H])c(C(=O)N([H])C([H])([H])[H])c2[H])S(=O)(=O)N(C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])[C@]1([H])C([H])([H])Oc1c([H])c([H])c([H])c([H])c1[H] |
| InChI | InChI=1S/C34H37N3O7S/c1-35-34(40)27-15-11-14-26(20-27)22-37-31(24-44-29-18-9-4-10-19-29)33(39)32(38)30(23-43-28-16-7-3-8-17-28)36(45(37,41)42)21-25-12-5-2-6-13-25/h2-20,30-33,38-39H,21-24H2,1H3,(H,35,40)/t30-,31-,32+,33+/m1/s1 |
| InChIKey | CGBDAHCDSVOMCF-FYZVQMPESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-{[(3R,4S,5S,6R)-7-benzyl-4,5-dihydroxy-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepan-2-yl]methyl}-N-methylbenzamide S,S-dioxide (CHEBI:44367) is a benzamides (CHEBI:22702) |
| 3-{[(3R,4S,5S,6R)-7-benzyl-4,5-dihydroxy-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepan-2-yl]methyl}-N-methylbenzamide S,S-dioxide (CHEBI:44367) is a sulfuric amide (CHEBI:38038) |
| 3-{[(3R,4S,5S,6R)-7-benzyl-4,5-dihydroxy-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepan-2-yl]methyl}-N-methylbenzamide S,S-dioxide (CHEBI:44367) is a sultam (CHEBI:46950) |
| 3-{[(3R,4S,5S,6R)-7-benzyl-4,5-dihydroxy-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepan-2-yl]methyl}-N-methylbenzamide S,S-dioxide (CHEBI:44367) is a thiadiazepane (CHEBI:46949) |
| Synonyms | Source |
|---|---|
| 3-(7-BENZYL-4,5-DIHYDROXY-1,1-DIOXO-3,6-BIS-PHENOXYMETHYL-1L6-[1,2,7]THIADIAZEPAN-2-YLMETHYL)-N-METHYL-BENZAMIDE | PDBeChem |
| 3-{[(3R,4S,5S,6R)-7-benzyl-4,5-dihydroxy-1,1-dioxido-3,6-bis(phenoxymethyl)-1,2,7-thiadiazepan-2-yl]methyl}-N-methylbenzamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| NM1 | PDBeChem |