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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 > hopanoid > hopane-6alpha,16alpha,22-triol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > hopanoid > hopane-6alpha,16alpha,22-triol

Preferred term

hopane-6alpha,16alpha,22-triol  

Type

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

Broader concept

charge

  • 0

formula

  • C30H52O3

inchi

  • InChI=1S/C30H52O3/c1-25(2)13-9-14-28(6)22-11-10-21-27(5)15-12-18(26(3,4)33)23(27)19(31)16-29(21,7)30(22,8)17-20(32)24(25)28/h18-24,31-33H,9-17H2,1-8H3/t18-,19+,20-,21?,22?,23?,24?,27+,28+,29+,30+/m0/s1

inchikey

  • CMCOTUOUAOOHNL-MNQFFLFYSA-N

mass

  • 460.743

monoisotopicmass

  • 460.39165

smiles

  • OC([C@@H]1C2[C@](C3[C@@]([C@]4(C([C@@]5(C(C(CCC5)(C)C)[C@H](C4)O)C)CC3)C)(C)C[C@H]2O)(C)CC1)(C)C

subset

  • 2_STAR

synonym EXACT

  • (3S,4R,5aR,5bR,7S,11aR,13bR)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene-4,7-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211760

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