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Chemistry, part 2

Content language

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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > botryosphaerin 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 acid > botryosphaerin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > botryosphaerin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > botryosphaerin d

Preferred term

botryosphaerin d  

Type

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

Broader concept

charge

  • 0

formula

  • C16H26O3

inchi

  • InChI=1S/C16H26O3/c1-11-5-6-13-15(2,10-17)7-4-8-16(13,3)12(11)9-14(18)19/h12-13,17H,1,4-10H2,2-3H3,(H,18,19)/t12-,13-,15+,16+/m0/s1

inchikey

  • MWKMUMSWEZPDMP-WMHQRMGPSA-N

mass

  • 266.381

monoisotopicmass

  • 266.18819

smiles

  • O=C(O)C[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@@]2(CO)C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[(1S,4aR,5S,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]acetic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206798

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