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Concept information

organooxygen compound > ester > carboxylic ester > phorbol ester > 16-hydroxyphorbol 13-decanoate 12-palmitate
organooxygen compound > carbonyl compound > carboxylic ester > phorbol ester > 16-hydroxyphorbol 13-decanoate 12-palmitate

Preferred term

16-hydroxyphorbol 13-decanoate 12-palmitate  

Type

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

charge

  • 0

formula

  • C38H60O9

inchi

  • InChI=1S/C38H60O9/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-31(42)46-34-26(3)37(45)29(32-35(5,24-40)38(32,34)47-27(4)41)21-28(23-39)22-36(44)30(37)20-25(2)33(36)43/h20-21,26,29-30,32,34,39-40,44-45H,6-19,22-24H2,1-5H3/t26-,29+,30-,32-,34-,35-,36-,37-,38-/m1/s1

inchikey

  • DYHBGVHTKOPQDM-SGPTVBMASA-N

mass

  • 660.87760

monoisotopicmass

  • 660.42373

smiles

  • [H][C@@]12C=C(CO)C[C@]3(O)C(=O)C(C)=C[C@@]3([H])[C@@]1(O)[C@H](C)[C@@H](OC(=O)CCCCCCCCCCCCCCC)[C@]1(OC(C)=O)[C@@]2([H])[C@@]1(C)CO

subset

  • 3_STAR

synonym EXACT

  • (1S,1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)-9a-acetoxy-4a,7b-dihydroxy-1,3-bis(hydroxymethyl)-1,6,8-trimethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl hexadecanoate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:744

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