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Chemistry, part 2

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Concept information

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

Preferred term

myrothecine f  

Type

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

Broader concept

charge

  • 0

formula

  • C29H38O10

inchi

  • InChI=1S/C29H38O10/c1-16(30)28-8-5-4-6-21(31)38-19-13-20-29(35)14-18-24(39-20)27(26(19,29)3,10-9-25(18,2)34)15-36-22(32)12-17(23(28)33)7-11-37-28/h4,6,12,18-20,23-24,33-35H,5,7-11,13-15H2,1-3H3/t18-,19+,20+,23-,24+,25-,26+,27+,28+,29-/m0/s1

inchikey

  • HGVKMRAJPCHSPC-XKVMYBEGSA-N

mass

  • 546.613

monoisotopicmass

  • 546.24650

smiles

  • O=C1OC[C@@]23[C@@]4([C@@]5(O)[C@H](O[C@@H]2[C@@H]([C@](O)(C)CC3)C5)C[C@H]4OC(=O)C=CCC[C@]6([C@H](C(=C1)CCO6)O)C(=O)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2S,3R,10S,19R,22S,23S,24R,26R,29S)-10-acetyl-1,22,29-trihydroxy-2,22-dimethyl-4,11,17,25-tetraoxahexacyclo[21.3.1.13,26.110,14.02,19.019,24]nonacosa-6,14-diene-5,16-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224149

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