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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > [(1s,2r,4ar,5r,8r,8ar)-1,8a-dihydroxy-3,8-dimethyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1h-naphthalen-2-yl] acetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > [(1s,2r,4ar,5r,8r,8ar)-1,8a-dihydroxy-3,8-dimethyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1h-naphthalen-2-yl] acetate

Preferred term

[(1s,2r,4ar,5r,8r,8ar)-1,8a-dihydroxy-3,8-dimethyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1h-naphthalen-2-yl] acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C17H26O4

inchi

  • InChI=1S/C17H26O4/c1-9(2)13-7-6-11(4)17(20)14(13)8-10(3)15(16(17)19)21-12(5)18/h8,11,13-16,19-20H,1,6-7H2,2-5H3/t11-,13+,14-,15-,16+,17-/m1/s1

inchikey

  • RXHIKAIVEMAPRU-JRIGQVHBSA-N

mass

  • 294.391

monoisotopicmass

  • 294.18311

smiles

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

subset

  • 2_STAR

synonym EXACT

  • [(1S,2R,4aR,5R,8R,8aR)-1,8a-dihydroxy-3,8-dimethyl-5-prop-1-en-2-yl-2,4a,5,6,7,8-hexahydro-1H-naphthalen-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218623

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