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

Preferred term

eremoxylarin a  

Type

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

Broader concept

charge

  • 0

formula

  • C28H38O6

inchi

  • InChI=1S/C28H38O6/c1-7-17(2)12-19(4)13-18(3)8-11-26(31)34-25-10-9-22(27(32)33)28(6)15-21(20(5)16-29)24(30)14-23(25)28/h8,11,13-14,16-17,19,21-22,25H,5,7,9-10,12,15H2,1-4,6H3,(H,32,33)/b11-8+,18-13+/t17?,19?,21-,22-,25-,28-/m1/s1

inchikey

  • JNXDHAJFIDNOLG-SRZGMPGVSA-N

mass

  • 470.606

monoisotopicmass

  • 470.26684

smiles

  • O=C1C=C2[C@]([C@@H](C(=O)O)CC[C@H]2OC(=O)/C=C/C(=C/C(CC(CC)C)C)/C)(C)C[C@@H]1C(C=O)=C

subset

  • 2_STAR

synonym EXACT

  • (1S,4R,7R,8aR)-8a-methyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-4-[(2E,4E)-4,6,8-trimethyldeca-2,4-dienoyl]oxy-1,2,3,4,7,8-hexahydronaphthalene-1-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215322

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