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Chemistry, part 2

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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 > triterpenoid > applanoxidic acid f
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > applanoxidic acid f

Preferred term

applanoxidic acid f  

Type

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

Broader concept

charge

  • 0

formula

  • C30H38O7

inchi

  • InChI=1S/C30H38O7/c1-15(10-17(31)11-16(2)25(35)36)18-12-23(34)29(7)28(18,6)22(33)13-20-27(5)9-8-21(32)26(3,4)19(27)14-24-30(20,29)37-24/h10,13,16,18-19,24H,8-9,11-12,14H2,1-7H3,(H,35,36)/b15-10+/t16?,18-,19+,24-,27+,28+,29-,30+/m1/s1

inchikey

  • IFIKIFMCHAMBFO-LOKDDDFESA-N

mass

  • 510.627

monoisotopicmass

  • 510.26175

smiles

  • O=C1C=C2[C@@]3([C@H](C(C(=O)CC3)(C)C)C[C@@H]4[C@]2(O4)[C@]5([C@]1([C@@H](/C(=C/C(=O)CC(C(=O)O)C)/C)CC5=O)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (E)-2-methyl-4-oxo-6-[(1R,3R,5R,10S,14R,15R,18R)-6,6,10,14,18-pentamethyl-7,13,17-trioxo-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadec-11-en-15-yl]hept-5-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204536

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