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Concept information

Preferred term

3بتا، 7 بتا، 15 آلفا، 24 تتراهیدروکسی 11،23 دی اکسولانوست 8 و اسید اوئیک 26  

Type

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

Broader concept

charge

  • 0

formula

  • C30H46O8

inchi

  • InChI=1S/C30H46O8/c1-14(10-18(32)25(36)15(2)26(37)38)16-11-22(35)30(7)24-17(31)12-20-27(3,4)21(34)8-9-28(20,5)23(24)19(33)13-29(16,30)6/h14-17,20-22,25,31,34-36H,8-13H2,1-7H3,(H,37,38)/t14-,15?,16-,17+,20+,21+,22+,25?,28+,29-,30+/m1/s1

inchikey

  • DHVGHNKIHZKJJA-YHRRMHMWSA-N

mass

  • 534.690

monoisotopicmass

  • 534.31927

smiles

  • O=C1C2=C([C@@]3([C@@H](O)C[C@@H]([C@]3(C1)C)[C@@H](CC(=O)C(O)C(C(=O)O)C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)O)C

subset

  • 2_STAR

synonym EXACT

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

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210395

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