skip to main content

Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

organooxygen compound > polyketide > macrolide > 4-desmethylepothilone d
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > 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 > 4-desmethylepothilone d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > 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 > 4-desmethylepothilone d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > 4-desmethylepothilone d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > 4-desmethylepothilone d

Preferred term

4-desmethylepothilone d  

Type

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

Broader concept

charge

  • 0

formula

  • C26H39NO5S

inchi

  • InChI=1S/C26H39NO5S/c1-15-8-7-9-16(2)25(30)19(5)26(31)18(4)22(28)13-24(29)32-23(11-10-15)17(3)12-21-14-33-20(6)27-21/h10,12,14,16,18-19,22-23,25,28,30H,7-9,11,13H2,1-6H3/b15-10-,17-12+/t16-,18?,19+,22-,23-,25-/m0/s1

inchikey

  • PPADMZQKLQKZMX-NJBAOKSHSA-N

mass

  • 477.660

monoisotopicmass

  • 477.25489

smiles

  • S1C(=NC(=C1)/C=C(/[C@H]2OC(=O)C[C@H](O)C(C(=O)[C@@H]([C@@H](O)[C@H](CCCC(=CC2)C)C)C)C)/C)C

subset

  • 2_STAR

synonym EXACT

  • (4S,7R,8S,9S,13Z,16S)-4,8-dihydroxy-5,7,9,13-tetramethyl-16-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-1-oxacyclohexadec-13-ene-2,6-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202689

Download this concept:

RDF/XML TURTLE JSON-LD