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Concept information

organooxygen compound > polyketide > macrolide > gageomacrolactin 3

Preferred term

gageomacrolactin 3  

Type

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

Broader concept

charge

  • 0

formula

  • C30H46O10

inchi

  • InChI=1S/C30H46O10/c1-21-13-7-3-2-4-8-14-22(32)19-23(33)15-9-5-10-16-24(17-11-6-12-18-26(34)38-21)39-30-29(37)28(36)27(35)25(20-31)40-30/h5-6,8-12,14,16,18,21-25,27-33,35-37H,2-4,7,13,15,17,19-20H2,1H3/b9-5-,11-6+,14-8+,16-10+,18-12-/t21-,22+,23+,24-,25+,27+,28-,29+,30+/m1/s1

inchikey

  • HUEUKSNRFPKEMR-VSIUFNMPSA-N

mass

  • 566.688

monoisotopicmass

  • 566.30910

smiles

  • O=C1O[C@@H](CCCCCC=C[C@H](O)C[C@@H](O)CC=CC=C[C@H](CC=CC=C1)O[C@H]2O[C@H]([C@H](O)[C@H]([C@@H]2O)O)CO)C

subset

  • 2_STAR

synonym EXACT

  • (3Z,5E,8S,9E,11Z,14S,16R,17E,24R)-14,16-dihydroxy-24-methyl-8-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclotetracosa-3,5,9,11,17-pentaen-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222676

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