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Chemistry, part 2

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Concept information

organooxygen compound > polyketide > macrolide > ts 155-2
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > ts 155-2
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > ts 155-2
... > 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 > lactone > macrocyclic lactone > macrolide > ts 155-2
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > ts 155-2
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > ts 155-2
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > ts 155-2
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > ts 155-2
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > ts 155-2
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > ts 155-2
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > ts 155-2

Preferred term

ts 155-2  

Type

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

Broader concept

charge

  • 0

formula

  • C39H60O11

inchi

  • InChI=1S/C39H60O11/c1-21(2)36-27(8)31(48-33(42)16-15-32(40)41)20-39(46,50-36)29(10)35(44)28(9)37-30(47-11)14-12-13-22(3)17-24(5)34(43)25(6)18-23(4)19-26(7)38(45)49-37/h12-16,18-19,21,24-25,27-31,34-37,43-44,46H,17,20H2,1-11H3,(H,40,41)

inchikey

  • PQLOHEMXTLVMFP-UHFFFAOYSA-N

mass

  • 704.898

monoisotopicmass

  • 704.41356

smiles

  • O=C1OC(C(OC)C=CC=C(CC(C(C(C=C(C=C1C)C)C)O)C)C)C(C(O)C(C2(OC(C(C)C(C2)OC(=O)C=CC(=O)O)C(C)C)O)C)C

subset

  • 2_STAR

synonym EXACT

  • (E)-4-[(2R,4R,5S,6R)-2-hydroxy-2-[(2S,3R,4S)-3-hydroxy-4-[(2R,3S,4E,6E,9S,10S,11R,12E,14E)-10-hydroxy-3-methoxy-7,9,11,13,15-pentamethyl-16-oxo-1-oxacyclohexadeca-4,6,12,14-tetraen-2-yl]pentan-2-yl]-5-methyl-6-propan-2-yloxan-4-yl]oxy-4-oxobut-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201552

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