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

Preferred term

ganoderic acid eta  

Type

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

Broader concept

charge

  • 0

formula

  • C30H44O8

inchi

  • InChI=1S/C30H44O8/c1-14(10-16(31)11-15(2)26(37)38)17-12-21(34)30(7)22-18(32)13-19-27(3,4)20(33)8-9-28(19,5)23(22)24(35)25(36)29(17,30)6/h11,14,16-20,25,31-33,36H,8-10,12-13H2,1-7H3,(H,37,38)/b15-11+/t14-,16+,17-,18+,19+,20+,25-,28+,29+,30+/m1/s1

inchikey

  • SFQSUCWHIWDMMD-CTKNUVLNSA-N

mass

  • 532.674

monoisotopicmass

  • 532.30362

smiles

  • O[C@H]1[C@]2([C@](C3=C([C@@]4([C@](C([C@@H](O)CC4)(C)C)(C[C@@H]3O)[H])C)C1=O)(C(=O)C[C@@]2([C@@H](C[C@H](O)/C=C(/C)/C(O)=O)C)[H])C)C

subset

  • 2_STAR

synonym EXACT

  • (E,4S,6R)-4-hydroxy-2-methyl-6-[(3S,5R,7S,10S,12S,13R,14R,17R)-3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]hept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183579

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