skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

organooxygen compound > ester > carboxylic ester > n-[(s)-[(1s,2r)-1-methyl-2-[(2r)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester
organooxygen compound > carbonyl compound > carboxylic ester > n-[(s)-[(1s,2r)-1-methyl-2-[(2r)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > n-[(s)-[(1s,2r)-1-methyl-2-[(2r)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > n-[(s)-[(1s,2r)-1-methyl-2-[(2r)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester

Preferred term

n-[(s)-[(1s,2r)-1-methyl-2-[(2r)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C29H32N2O3

has_functional_parent

inchi

  • InChI=1S/C29H32N2O3/c1-21(27(32)30-19-22-12-6-3-7-13-22)25-18-29(25,2)26(24-16-10-5-11-17-24)31-28(33)34-20-23-14-8-4-9-15-23/h3-17,21,25-26H,18-20H2,1-2H3,(H,30,32)(H,31,33)/t21-,25-,26-,29+/m1/s1

inchikey

  • WQTGKLHQESDVBY-UXJUWBFNSA-N

mass

  • 456.577

monoisotopicmass

  • 456.24129

smiles

  • C[C@H]([C@H]1C[C@]1(C)[C@@H](C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116280

Download this concept:

RDF/XML TURTLE JSON-LD