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Chemistry, part 2

Content language

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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 > lipid > liposaccharide > glycolipid > sophorolipid > gl2a
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > liposaccharide > glycolipid > sophorolipid > gl2a

Preferred term

gl2a  

Type

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

Broader concept

charge

  • 0

formula

  • C52H94O15

inchi

  • InChI=1S/C52H94O15/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-23-28-32-44(56)64-40(36-62-43(55)31-27-24-20-22-26-30-39-33-38(39)29-25-21-10-8-6-4-2)37-63-52-50(48(60)46(58)42(35-54)66-52)67-51-49(61)47(59)45(57)41(34-53)65-51/h14-15,38-42,45-54,57-61H,3-13,16-37H2,1-2H3/b15-14-/t38?,39?,40-,41-,42-,45+,46-,47+,48+,49-,50-,51-,52+/m1/s1

inchikey

  • NFMMZNHSINJCBG-DCCWOIOJSA-N

mass

  • 959.309

monoisotopicmass

  • 958.65927

smiles

  • O=C(O[C@H](COC(=O)CCCCCCCC1C(CCCCCCCC)C1)CO[C@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O[C@H]3O[C@@H]([C@H](O)[C@@H]([C@H]3O)O)CO)O)CO)CCCCCCC/C=C/CCCCCCCC

subset

  • 2_STAR

synonym EXACT

  • [(2S)-1-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-[8-(2-octylcyclopropyl)octanoyloxy]propan-2-yl] (Z)-octadec-9-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217834

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