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Concept information

organooxygen compound > ether > soraphen a

Preferred term

soraphen a  

Type

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

alt_id

  • CHEBI:45464

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/b17-16+/t18-,19-,20+,22-,23-,24+,25-,26-,27+,29+/m0/s1

inchikey

  • WPMGNXPRKGXGBO-OFQQMTDKSA-N

mass

  • 520.65490

monoisotopicmass

  • 520.30362

smiles

  • CO[C@@H]1[C@@H](O)[C@H](C)[C@H]2O[C@]1(O)[C@H](C)C(=O)O[C@@H](CCCC[C@H](OC)[C@H](OC)/C=C/[C@@H]2C)c1ccccc1

subset

  • 3_STAR

synonym EXACT

  • (1R,2S,5S,10S,11R,12E,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:9200

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