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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > osas#10(1-)

Preferred term

osas#10(1-)  

Type

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

Broader concept

charge

  • -1

formula

  • C27H40NO10

inchi

  • InChI=1S/C27H41NO10/c1-17(7-5-3-4-6-8-25(33)34)36-27-21(30)15-23(18(2)37-27)38-26(35)14-13-24(32)28-16-22(31)19-9-11-20(29)12-10-19/h9-12,17-18,21-23,27,29-31H,3-8,13-16H2,1-2H3,(H,28,32)(H,33,34)/p-1/t17?,18?,21?,22-,23+,27+/m0/s1

inchikey

  • SCVSSJPXRIMMTB-QHPTULIBSA-M

mass

  • 538.608

monoisotopicmass

  • 538.26577

smiles

  • [H]C(C)(CCCCCCC([O-])=O)O[C@]1([H])OC([H])(C)[C@@]([H])(CC1([H])O)OC(=O)CCC(=O)NC[C@]([H])(O)C2=CC=C(O)C=C2

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:140796

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