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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 > 3beta-hydroxy-22(30)-hopen-29-al
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > hopanoid > 3beta-hydroxy-22(30)-hopen-29-al

Preferred term

3beta-hydroxy-22(30)-hopen-29-al  

Type

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

Broader concept

charge

  • 0

formula

  • C30H48O2

inchi

  • InChI=1S/C30H48O2/c1-19(18-31)20-10-14-27(4)21(20)11-16-29(6)23(27)8-9-24-28(5)15-13-25(32)26(2,3)22(28)12-17-30(24,29)7/h18,20-25,32H,1,8-17H2,2-7H3/t20-,21-,22?,23+,24?,25-,27-,28-,29+,30+/m0/s1

inchikey

  • IXBAWFNSWVWXAS-DJDCKNGGSA-N

mass

  • 440.712

monoisotopicmass

  • 440.36543

smiles

  • O[C@@H]1C(C2[C@@](C3[C@]([C@]4([C@@]([C@@]5([C@@](CC4)([C@@H](CC5)C(C=O)=C)[H])C)(CC3)[H])C)(CC2)C)(CC1)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[(3R,3aS,5aR,5bR,9S,11aR,13aR,13bS)-9-hydroxy-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]chrysen-3-yl]prop-2-enal

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:171684

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