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

Preferred term

inonotsutriol d  

Type

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

Broader concept

charge

  • 0

formula

  • C30H50O3

inchi

  • InChI=1S/C30H50O3/c1-18(2)23(31)17-24(32)19(3)20-11-15-30(8)22-9-10-25-27(4,5)26(33)13-14-28(25,6)21(22)12-16-29(20,30)7/h19-20,23-26,31-33H,1,9-17H2,2-8H3/t19-,20+,23+,24+,25-,26-,28+,29+,30-/m0/s1

inchikey

  • HPSNYACQJUVHEL-BLKIGZGFSA-N

mass

  • 458.727

monoisotopicmass

  • 458.37600

smiles

  • O[C@@H]1C([C@H]2[C@](C3=C([C@]4([C@]([C@@H]([C@@H]([C@H](O)C[C@@H](O)C(=C)C)C)CC4)(C)CC3)C)CC2)(C)CC1)(C)C

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219838

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