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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 > ganotheaecoloid c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > ganotheaecoloid c

Preferred term

ganotheaecoloid c  

Type

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

Broader concept

charge

  • 0

formula

  • C21H28O6

inchi

  • InChI=1S/C21H28O6/c1-12-4-9-19(25)21(2,3)16(12)7-5-13(20(26)27)10-18(24)15-11-14(22)6-8-17(15)23/h6,8,11,13,16,19,22-23,25H,1,4-5,7,9-10H2,2-3H3,(H,26,27)/t13?,16-,19+/m1/s1

inchikey

  • LABIJKGJRWZQNA-HIYLDEIPSA-N

mass

  • 376.449

monoisotopicmass

  • 376.18859

smiles

  • O=C(O)C(CC(=O)C1=C(O)C=CC(=C1)O)CC[C@@H]2C(=C)CC[C@@H](C2(C)C)O

subset

  • 2_STAR

synonym EXACT

  • 4-(2,5-dihydroxyphenyl)-2-[2-[(1R,3S)-3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl]ethyl]-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217450

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