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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > (-)-(6z,12e,2s,3s,4r,5r,9s,11s,15r)-3-acetoxy-15-benzoyloxylathyra-6,12-dien-5-ol-14-one
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > (-)-(6z,12e,2s,3s,4r,5r,9s,11s,15r)-3-acetoxy-15-benzoyloxylathyra-6,12-dien-5-ol-14-one
organooxygen compound > ester > carboxylic ester > acetate ester > (-)-(6z,12e,2s,3s,4r,5r,9s,11s,15r)-3-acetoxy-15-benzoyloxylathyra-6,12-dien-5-ol-14-one
organooxygen compound > carbonyl compound > carboxylic ester > acetate ester > (-)-(6z,12e,2s,3s,4r,5r,9s,11s,15r)-3-acetoxy-15-benzoyloxylathyra-6,12-dien-5-ol-14-one

Preferred term

(-)-(6z,12e,2s,3s,4r,5r,9s,11s,15r)-3-acetoxy-15-benzoyloxylathyra-6,12-dien-5-ol-14-one  

Type

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

Broader concept

charge

  • 0

formula

  • C29H36O6

has_role

inchi

  • InChI=1S/C29H36O6/c1-16-12-13-21-22(28(21,5)6)14-17(2)26(32)29(35-27(33)20-10-8-7-9-11-20)15-18(3)25(34-19(4)30)23(29)24(16)31/h7-12,14,18,21-25,31H,13,15H2,1-6H3/b16-12-,17-14+/t18-,21-,22+,23-,24-,25-,29+/m0/s1

inchikey

  • MZSLFIHMXSUKAF-JAQVJURHSA-N

mass

  • 480.59250

monoisotopicmass

  • 480.25119

smiles

  • C[C@H]1C[C@@]2(OC(=O)c3ccccc3)[C@H]([C@H]1OC(C)=O)[C@@H](O)/C(C)=C/C[C@H]1[C@@H](/C=C(C)/C2=O)C1(C)C

subset

  • 3_STAR

synonym EXACT

  • (1aR,2E,4aR,6S,7S,7aS,9Z,11aS)-7-(acetyloxy)-8-hydroxy-1,1,3,6,9-pentamethyl-4-oxo-1,1a,4,5,6,7,7a,8,11,11a-decahydro-4aH-cyclopenta[a]cyclopropa[f][11]annulen-4a-yl benzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:67700

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