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Chemistry, part 2

Content language

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Concept information

organooxygen compound > polyketide > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > 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 > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > 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 > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > 8-demethyl epothilone a 3-alpha-d-arabinofuranoside

Preferred term

8-demethyl epothilone a 3-alpha-d-arabinofuranoside  

Type

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

Broader concept

charge

  • 0

formula

  • C30H45NO10S

inchi

  • InChI=1S/C30H45NO10S/c1-15(10-18-14-42-17(3)31-18)21-11-22-20(38-22)9-7-6-8-19(33)16(2)28(37)30(4,5)24(12-25(34)39-21)41-29-27(36)26(35)23(13-32)40-29/h10,14,16,19-24,26-27,29,32-33,35-36H,6-9,11-13H2,1-5H3/b15-10+/t16-,19+,20-,21+,22+,23-,24+,26-,27?,29-/m1/s1

inchikey

  • KIRUUCDTXBZETK-IZLMMKDCSA-N

mass

  • 611.750

monoisotopicmass

  • 611.27642

smiles

  • S1C(=NC(=C1)/C=C(/[C@H]2OC(=O)C[C@H](O[C@H]3O[C@H](CO)[C@H](C3O)O)C(C(=O)[C@@H]([C@@H](O)CCCC[C@@H]4[C@H](C2)O4)C)(C)C)/C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,3S,7S,10R,11S,16R)-7-[(2S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-11-hydroxy-8,8,10-trimethyl-3-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-4,17-dioxabicyclo[14.1.0]heptadecane-5,9-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217660

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