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Chemistry, part 2

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

Preferred term

obliquol  

Type

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

Broader concept

charge

  • 0

formula

  • C30H50O2

inchi

  • InChI=1S/C30H50O2/c1-19(2)10-9-11-20(3)21-14-17-29(7)22-12-13-24-27(4,5)25(31)15-16-28(24,6)23(22)18-26(32)30(21,29)8/h10,20-21,24-26,31-32H,9,11-18H2,1-8H3/t20-,21?,24+,25-,26-,28-,29+,30+/m1/s1

inchikey

  • CSYGXJQNODZRQO-XFAWHCPVSA-N

mass

  • 442.728

monoisotopicmass

  • 442.38108

smiles

  • O[C@H]1C([C@H]2[C@](C3=C([C@]4([C@](C([C@@H](CCC=C(C)C)C)CC4)(C)[C@@H](C3)O)C)CC2)(C)CC1)(C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,5R,10S,12R,13R,14S)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,12-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209486

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