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Chemistry, part 1

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > organooxygen compound > carbon oxoacid > carboxylic acid > monocarboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > monocarboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > organooxygen compound > carbonyl compound > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > organooxygen compound > carbon oxoacid > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > hydroxy carboxylic acid > hydroxy monocarboxylic acid > dihydroxy monocarboxylic acid > hederagenin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > triterpenoid > pentacyclic triterpenoid > hederagenin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > pentacyclic triterpenoid > hederagenin

Preferred term

hederagenin  

Type

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

Broader concept

charge

  • 0

formula

  • C30H48O4

has_functional_parent

has_parent_hydride

has_role

inchi

  • InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1

inchikey

  • PGOYMURMZNDHNS-MYPRUECHSA-N

is_conjugate_acid_of

mass

  • 472.69970

monoisotopicmass

  • 472.35526

smiles

  • [H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)[C@@](C)(CO)[C@]3([H])CC[C@@]12C)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • (3beta)-3,23-dihydroxyolean-12-en-28-oic acid

synonym RELATED

  • Astrantiagenin E
  • Caulosapogenin
  • Hederagenic acid
  • Hederagenol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69579

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