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Concept information

Preferred term

3 استیل گانودرمادیول  

Type

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

Broader concept

charge

  • 0

formula

  • C32H50O3

inchi

  • InChI=1S/C32H50O3/c1-21(20-33)10-9-11-22(2)24-14-18-32(8)26-12-13-27-29(4,5)28(35-23(3)34)16-17-30(27,6)25(26)15-19-31(24,32)7/h10,12,15,22,24,27-28,33H,9,11,13-14,16-20H2,1-8H3/b21-10+/t22-,24-,27+,28+,30-,31-,32+/m1/s1

inchikey

  • XZPGUQWQPJEACY-UIAQYYJJSA-N

mass

  • 482.749

monoisotopicmass

  • 482.37600

smiles

  • O=C(O[C@@H]1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CC/C=C(/CO)/C)C)CC4)(C)CC3)C)=CC2)(C)CC1)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • [(3S,5R,10S,13R,14R,17R)-17-[(E,2R)-7-hydroxy-6-methylhept-5-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227960

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