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Chemistry, part 2

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Concept information

organooxygen compound > polyketide > macrolide > soraphen a1alpha
... > organooxygen compound > ester > carboxylic ester > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > 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 > soraphen a1alpha
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > organooxygen compound > ester > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > organooxygen compound > oxacycle > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > 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 > soraphen a1alpha
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > macrocyclic lactone > macrolide > soraphen a1alpha
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > macrocycle > macrocyclic lactone > macrolide > soraphen a1alpha

Preferred term

soraphen a1alpha  

Type

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

Broader concept

charge

  • 0

formula

  • C29H44O8

inchi

  • InChI=1S/C29H44O8/c1-18-16-17-24(34-5)23(33-4)15-11-10-14-22(21-12-8-7-9-13-21)36-28(31)20(3)29(32)27(35-6)25(30)19(2)26(18)37-29/h7-9,12-13,16-20,22-27,30,32H,10-11,14-15H2,1-6H3/t18-,19-,20+,22-,23+,24+,25-,26-,27+,29?/m0/s1

inchikey

  • WPMGNXPRKGXGBO-QFLLDXAESA-N

mass

  • 520.663

monoisotopicmass

  • 520.30362

smiles

  • O=C1O[C@H](C2=CC=CC=C2)CCCC[C@@H](OC)[C@H](OC)C=C[C@@H]([C@@H]3OC([C@@H]1C)(O)[C@H](OC)[C@@H](O)[C@@H]3C)C

subset

  • 2_STAR

synonym EXACT

  • (2S,5S,10R,11R,14S,15S,16S,17S,18R)-1,17-dihydroxy-10,11,18-trimethoxy-2,14,16-trimethyl-5-phenyl-4,19-dioxabicyclo[13.3.1]nonadec-12-en-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214367

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