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Concept information

organooxygen compound > polyketide > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > 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 > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > 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 > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > (3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one

Preferred term

(3s,5e,7s,8s)-13,15-dibromo-3,4,7,8,9,10-hexahydro-7,8,9,16-tetrahydroxy-14-methoxy-3-methyl-1h-2-benzooxacyclotetradecin-1-one  

Type

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

Broader concept

charge

  • 0

formula

  • C19H22Br2O7

inchi

  • InChI=1S/C19H22Br2O7/c1-9-5-3-7-11(22)16(24)12(23)8-4-6-10-13(19(26)28-9)17(25)15(21)18(27-2)14(10)20/h3-4,6-7,9,11-12,16,22-25H,5,8H2,1-2H3/t9-,11-,12+,16+/m0/s1

inchikey

  • JZBCFYFXBXJTKB-UCIVKPIZSA-N

mass

  • 522.186

monoisotopicmass

  • 519.97323

smiles

  • BrC1=C(OC)C(Br)=C2C=CC[C@@H](O)[C@H](O)[C@@H](O)C=CC[C@@H](OC(C2=C1O)=O)C

subset

  • 2_STAR

synonym EXACT

  • (4S,8S,9S,10R)-15,17-dibromo-8,9,10,18-tetrahydroxy-16-methoxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),6,12,15,17-pentaen-2-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210915

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