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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > euphorbiaproliferin d
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > euphorbiaproliferin d

Preferred term

euphorbiaproliferin d  

Type

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

Broader concept

charge

  • 0

formula

  • C36H44O12

has_role

inchi

  • InChI=1S/C36H44O12/c1-9-26(41)45-28-19(2)17-36(48-22(5)39)27(28)30(44-20(3)37)35-18-43-34(8,32(36)46-31(42)23-13-11-10-12-14-23)29(35)24(15-16-25(35)40)33(6,7)47-21(4)38/h10-16,19,24,27-30,32H,9,17-18H2,1-8H3/t19-,24-,27+,28-,29-,30+,32-,34+,35+,36+/m0/s1

inchikey

  • SRKVJOIQCZXSCT-PQTFDODOSA-N

mass

  • 668.72740

monoisotopicmass

  • 668.28328

smiles

  • [H][C@]12[C@@H](OC(=O)CC)[C@@H](C)C[C@]1(OC(C)=O)[C@@H](OC(=O)c1ccccc1)[C@]1(C)OC[C@@]3([C@@H]2OC(C)=O)C(=O)C=C[C@@H]([C@@]13[H])C(C)(C)OC(C)=O

subset

  • 2_STAR

synonym RELATED

  • 3beta-O-propionyl-5alpha,10,15beta-tri-O-acetyl-7-oxo-14beta-O-benzoyl-10,18-dihydromyrsinol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69715

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