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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 > (24e)-3beta-acetoxy-15alpha-hydroxy-7-oxolanosta-8,24-dien-26-oicacid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > (24e)-3beta-acetoxy-15alpha-hydroxy-7-oxolanosta-8,24-dien-26-oicacid

Preferred term

(24e)-3beta-acetoxy-15alpha-hydroxy-7-oxolanosta-8,24-dien-26-oicacid  

Type

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

Broader concept

charge

  • 0

formula

  • C32H48O6

inchi

  • InChI=1S/C32H48O6/c1-18(10-9-11-19(2)28(36)37)22-16-25(35)32(8)27-21(12-15-31(22,32)7)30(6)14-13-26(38-20(3)33)29(4,5)24(30)17-23(27)34/h11,18,22,24-26,35H,9-10,12-17H2,1-8H3,(H,36,37)/b19-11+/t18-,22-,24+,25+,26+,30-,31-,32+/m1/s1

inchikey

  • KXSRWTNYHOCSFB-TVURBSCFSA-N

mass

  • 528.730

monoisotopicmass

  • 528.34509

smiles

  • O=C1C2=C([C@]3(CC[C@@H](C([C@@H]3C1)(C)C)OC(=O)C)C)CC[C@]4([C@]2([C@@H](O)C[C@@H]4[C@@H](CC/C=C(/C(=O)O)/C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (E,6R)-6-[(3S,5R,10S,13R,14R,15S,17R)-3-acetyloxy-15-hydroxy-4,4,10,13,14-pentamethyl-7-oxo-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207374

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