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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 > 3alpha,15alpha-diacetoxy-(22r)-hydroxylanosta-7,9(11),24-trien-26-oic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > 3alpha,15alpha-diacetoxy-(22r)-hydroxylanosta-7,9(11),24-trien-26-oic acid

Preferred term

3alpha,15alpha-diacetoxy-(22r)-hydroxylanosta-7,9(11),24-trien-26-oic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C34H50O7

inchi

  • InChI=1S/C34H50O7/c1-19(30(38)39)10-12-26(37)20(2)25-18-29(41-22(4)36)34(9)24-11-13-27-31(5,6)28(40-21(3)35)15-16-32(27,7)23(24)14-17-33(25,34)8/h10-11,14,20,25-29,37H,12-13,15-18H2,1-9H3,(H,38,39)/b19-10+

inchikey

  • XITBGHDSLKRVMR-VXLYETTFSA-N

mass

  • 570.767

monoisotopicmass

  • 570.35565

smiles

  • O(C1C2(C(C(C1)C(C(O)C/C=C(/C)/C(O)=O)C)(CC=C3C4(C(C(C(OC(=O)C)CC4)(C)C)CC=C23)C)C)C)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • (E)-6-(3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-5-hydroxy-2-methylhept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176106

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