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Chemistry, part 2

Content language

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Concept information

organooxygen compound > polyketide > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > 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 > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > 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 > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > 23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester

Preferred term

23-(6-methyl)heptanoic acid demalonylazalomycin f4a ester  

Type

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

Broader concept

charge

  • 0

formula

  • C61H107N3O15

inchi

  • InChI=1S/C61H107N3O15/c1-38(2)21-16-17-27-56(73)77-48-32-46(65)31-47(66)33-51(68)39(3)23-19-25-43(7)57(42(6)22-15-13-11-12-14-18-30-64-60(62)63-10)78-59(75)44(8)26-20-24-40(4)52(69)36-53(70)45(9)50(67)29-28-41(5)55(72)37-61(76)58(74)54(71)35-49(34-48)79-61/h11-12,19-20,23-26,38,40-43,45-55,57-58,65-72,74,76H,13-18,21-22,27-37H2,1-10H3,(H3,62,63,64)/t40?,41-,42-,43?,45?,46+,47+,48-,49-,50?,51-,52?,53?,54+,55-,57-,58-,61+/m0/s1

inchikey

  • FAMPEBFAKCFKOL-HJSYUDIGSA-N

mass

  • 1122.533

monoisotopicmass

  • 1121.77022

smiles

  • O=C1O[C@H](C(C=CC=C([C@@H](O)C[C@H](O)C[C@@H](O)C[C@H](OC(=O)CCCCC(C)C)C[C@@H]2O[C@@](C[C@@H]([C@H](CCC(C(C(CC(C(C=CC=C1C)C)O)O)C)O)C)O)(O)[C@@H](O)[C@@H](C2)O)C)C)[C@H](CCCC=CCCCNC(=NC)N)C

subset

  • 2_STAR

synonym EXACT

  • [(1R,3S,5R,7R,9S,15S,30S,31S,33R,34S,35R)-5,7,9,23,25,27,31,33,34,35-decahydroxy-10,14,18,22,26,30-hexamethyl-15-[(2S)-10-[(N'-methylcarbamimidoyl)amino]dec-6-en-2-yl]-17-oxo-16,37-dioxabicyclo[31.3.1]heptatriaconta-10,12,18,20-tetraen-3-yl] 6-methylheptanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219963

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