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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 > organic hydroxy compound > alcohol > secondary alcohol > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
organooxygen compound > ester > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
organooxygen compound > oxacycle > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > triterpenoid > hexacyclic triterpenoid > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > hexacyclic triterpenoid > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > hexacyclic triterpenoid > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > hexacyclic triterpenoid > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > hexacyclic triterpenoid > 3alpha-hydroxyolean-11-en-28,13beta-olide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > hexacyclic triterpenoid > 3alpha-hydroxyolean-11-en-28,13beta-olide

Preferred term

3alpha-hydroxyolean-11-en-28,13beta-olide  

Type

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

Broader concept

charge

  • 0

formula

  • C30H46O3

has_parent_hydride

has_role

inchi

  • InChI=1S/C30H46O3/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-19-25(3,4)22(31)10-11-26(19,5)20(27)9-13-30(28,21(29)18-24)33-23(29)32/h9,13,19-22,31H,8,10-12,14-18H2,1-7H3/t19-,20+,21+,22+,26-,27+,28-,29-,30-/m0/s1

inchikey

  • VQUPEZXRIUOIJE-XDPQSBAJSA-N

mass

  • 454.68440

monoisotopicmass

  • 454.34470

smiles

  • CC1(C)CC[C@@]23CC[C@]4(C)[C@](OC2=O)(C=C[C@@H]2[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@@]42C)[C@@H]3C1

subset

  • 3_STAR

synonym EXACT

  • (3alpha)-3-hydroxy-13,28-epoxyolean-11-en-28-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69224

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