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CHEBI:41369 - (4-{2-ACETYLAMINO-2-[1-(3-CARBAMOYL-4-CYCLOHEXYLMETHOXY-PHENYL)-ETHYLCARBAMOYL}-ETHYL}-2-PHOSPHONO-PHENOXY)-ACETIC ACID

Default Structure
ChEBI IDCHEBI:41369
ChEBI Name(4-{2-ACETYLAMINO-2-[1-(3-CARBAMOYL-4-CYCLOHEXYLMETHOXY-PHENYL)-ETHYLCARBAMOYL}-ETHYL}-2-PHOSPHONO-PHENOXY)-ACETIC ACID
Stars
DownloadsMolfile
FormulaC29H38N3O10P
Net Charge0
Average Mass619.608
Monoisotopic Mass619.22948
SMILES[H]OC(=O)C([H])([H])Oc1c([H])c([H])c(C([H])([H])[C@@]([H])(C(=O)N([H])[C@]([H])(c2c([H])c([H])c(OC([H])([H])C3([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)N([H])[H])c2[H])C([H])([H])[H])N([H])C(=O)C([H])([H])[H])c([H])c1P(=O)(O[H])O[H]
InChIInChI=1S/C29H38N3O10P/c1-17(21-9-11-24(22(14-21)28(30)36)41-15-19-6-4-3-5-7-19)31-29(37)23(32-18(2)33)12-20-8-10-25(42-16-27(34)35)26(13-20)43(38,39)40/h8-11,13-14,17,19,23H,3-7,12,15-16H2,1-2H3,(H2,30,36)(H,31,37)(H,32,33)(H,34,35)(H2,38,39,40)/t17-,23-/m0/s1
InChIKeyFXUGQWABROMTDA-SBUREZEXSA-N
ChEBI Ontology
Outgoing Relation(s)
(4-{2-ACETYLAMINO-2-[1-(3-CARBAMOYL-4-CYCLOHEXYLMETHOXY-PHENYL)-ETHYLCARBAMOYL}-ETHYL}-2-PHOSPHONO-PHENOXY)-ACETIC ACID (CHEBI:41369) is a unclassifieds (CHEBI:27189)
Synonym  Source
(4-{2-ACETYLAMINO-2-[1-(3-CARBAMOYL-4-CYCLOHEXYLMETHOXY-PHENYL)-ETHYLCARBAMOYL}-ETHYL}-2-PHOSPHONO-PHENOXY)-ACETIC ACIDPDBeChem
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