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Chemistry, part 2

Content language

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Concept information

organooxygen compound > polyketide > macrolide > antibiotic 170t
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > 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 > antibiotic 170t
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > 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 > antibiotic 170t
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > antibiotic 170t
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > antibiotic 170t

Preferred term

antibiotic 170t  

Type

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

Broader concept

charge

  • 0

formula

  • C42H68O12

inchi

  • InChI=1S/C42H68O12/c1-9-29-21-33-13-17-35(51-33)25(5)39(43)47-24(4)20-32-12-16-38(50-32)28(8)42(46)54-30(10-2)22-34-14-18-36(52-34)26(6)40(44)48-23(3)19-31-11-15-37(49-31)27(7)41(45)53-29/h23-38H,9-22H2,1-8H3/t23-,24-,25-,26-,27+,28+,29+,30+,31-,32-,33+,34+,35-,36-,37+,38+/m0/s1

inchikey

  • ZBDGIMZKOJALMU-HXUSMMTHSA-N

mass

  • 764.994

monoisotopicmass

  • 764.47108

smiles

  • O1[C@@]2(CC[C@]1([C@@H](C(O[C@H](C[C@]3(O[C@](CC3)([C@H](C(O[C@@H](C[C@@]4(O[C@@](CC4)([C@@H](C(O[C@H](C[C@]5(O[C@](CC5)([C@H](C(O[C@@H](C2)CC)=O)C)[H])[H])C)=O)C)[H])[H])CC)=O)C)[H])[H])C)=O)C)[H])[H]

subset

  • 2_STAR

synonym EXACT

  • (1R,2R,5R,7R,10S,11S,14S,16S,19R,20R,23R,25R,28S,29S,32S,34S)-5,23-diethyl-2,11,14,20,29,32-hexamethyl-4,13,22,31,37,38,39,40-octaoxapentacyclo[32.2.1.17,10.116,19.125,28]tetracontane-3,12,21,30-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:182064

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