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Chemistry, part 2

Content language

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Concept information

organooxygen compound > polyketide > macrolide > borrelidin l
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin l
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin l
... > 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 > borrelidin l
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > borrelidin l
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > borrelidin l
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin l
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin l
... > 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 > borrelidin l
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > borrelidin l
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > borrelidin l

Preferred term

borrelidin l  

Type

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

Broader concept

charge

  • 0

formula

  • C28H43NO7

inchi

  • InChI=1S/C28H43NO7/c1-16-12-17(2)26(32)19(4)23(30)14-25(31)36-24(21-9-7-10-22(21)28(34)35)11-6-5-8-20(15-29)27(33)18(3)13-16/h5-6,8,16-19,21-24,26-27,30,32-33H,7,9-14H2,1-4H3,(H,34,35)/t16-,17+,18+,19-,21-,22-,23+,24+,26+,27-/m1/s1

inchikey

  • SIOKKMJNZJVHPS-VTKHTTOASA-N

mass

  • 505.652

monoisotopicmass

  • 505.30395

smiles

  • O=C1O[C@H]([C@H]2[C@H](C(=O)O)CCC2)CC=CC=C(C#N)[C@H](O)[C@@H](C)C[C@@H](C[C@@H]([C@@H]([C@@H]([C@H](C1)O)C)O)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2R)-2-[(2S,8R,9S,11R,13S,14S,15R,16S)-7-cyano-8,14,16-trihydroxy-9,11,13,15-tetramethyl-18-oxo-1-oxacyclooctadeca-4,6-dien-2-yl]cyclopentane-1-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218080

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