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Chemistry, part 1

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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > cyclodepsipeptide > beauvenniatin e
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > cyclodepsipeptide > beauvenniatin e
organooxygen compound > ester > lactone > cyclodepsipeptide > beauvenniatin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > beauvenniatin e
... > organooxygen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > beauvenniatin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > depsipeptide > cyclodepsipeptide > beauvenniatin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > beauvenniatin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > beauvenniatin e

Preferred term

beauvenniatin e  

Type

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

Broader concept

charge

  • 0

formula

  • C41H57N3O10

inchi

  • InChI=1S/C41H57N3O10/c1-23(2)32-41(51)54-34(25(5)6)37(47)42(9)30(21-27-15-13-12-14-16-27)39(49)52-33(24(3)4)36(46)43(10)31(22-28-17-19-29(45)20-18-28)40(50)53-35(26(7)8)38(48)44(32)11/h12-20,23-26,30-35,45H,21-22H2,1-11H3/t30-,31-,32-,33+,34+,35+/m0/s1

inchikey

  • XIXBJSDMBQLFQF-DULUVLRMSA-N

mass

  • 751.918

monoisotopicmass

  • 751.40440

smiles

  • O=C1O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(O[C@@H](C(N([C@H]1C(C)C)C)=O)C(C)C)=O)CC2=CC=C(O)C=C2)C)C(C)C)CC3=CC=CC=C3)C)C(C)C

subset

  • 2_STAR

synonym EXACT

  • (3S,6R,9S,12R,15S,18R)-3-benzyl-15-[(4-hydroxyphenyl)methyl]-4,10,16-trimethyl-6,9,12,18-tetra(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220278

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