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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > fatty acid ester > preaustinoid d
organooxygen compound > carbonyl compound > carboxylic ester > fatty acid ester > preaustinoid 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 > fatty acid ester > preaustinoid d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > fatty acid ester > preaustinoid d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > fatty acid ester > preaustinoid d

Preferred term

preaustinoid d  

Type

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

Broader concept

charge

  • 0

formula

  • C27H40O8

inchi

  • InChI=1S/C27H40O8/c1-15-24(5)14-17-23(4,12-11-18(28)34-8)16(22(2,3)32)10-13-25(17,6)27(15,21(31)35-9)20(30)26(7,33)19(24)29/h16-17,32-33H,1,10-14H2,2-9H3/t16-,17+,23-,24-,25+,26+,27+/m0/s1

inchikey

  • JRXXIWDNTKRQEY-XEOWCUFHSA-N

mass

  • 492.609

monoisotopicmass

  • 492.27232

smiles

  • O=C1[C@]2(C(=C)[C@@](C[C@H]3[C@]2(CC[C@H]([C@@]3(CCC(=O)OC)C)C(O)(C)C)C)(C)C([C@]1(O)C)=O)C(=O)OC

subset

  • 2_STAR

synonym EXACT

  • methyl (1S,2R,5R,6R,7R,9S,11R)-11-hydroxy-5-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-2,6,9,11-tetramethyl-13-methylidene-10,12-dioxotricyclo[7.3.1.02,7]tridecane-1-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210073

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