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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 > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > organooxygen compound > carbonyl compound > ketone > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > 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 > ketone > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha-hydroxy ketone > secondary alpha-hydroxy ketone > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > triterpenoid > tetracyclic triterpenoid > tirucallane triterpenoid > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > tetracyclic triterpenoid > tirucallane triterpenoid > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > organic tetracyclic compound > tetracyclic triterpenoid > tirucallane triterpenoid > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > 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 > organic tetracyclic compound > tetracyclic triterpenoid > tirucallane triterpenoid > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > organic tetracyclic compound > tetracyclic triterpenoid > tirucallane triterpenoid > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > organic tetracyclic compound > tetracyclic triterpenoid > tirucallane triterpenoid > 3beta,22s-dihydroxytirucalla-7,24-dien-23-one

Preferred term

3beta,22s-dihydroxytirucalla-7,24-dien-23-one  

Type

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

Broader concept

charge

  • 0

formula

  • C30H48O3

has_role

inchi

  • InChI=1S/C30H48O3/c1-18(2)17-23(31)26(33)19(3)20-11-15-30(8)22-9-10-24-27(4,5)25(32)13-14-28(24,6)21(22)12-16-29(20,30)7/h9,17,19-21,24-26,32-33H,10-16H2,1-8H3/t19-,20+,21+,24+,25+,26+,28-,29+,30-/m1/s1

inchikey

  • VLJVSIPTYGANIN-YWCQBWSOSA-N

mass

  • 456.70030

monoisotopicmass

  • 456.36035

smiles

  • C[C@@H]([C@H](O)C(=O)C=C(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C

subset

  • 3_STAR

synonym EXACT

  • (3beta,13alpha,14beta,17alpha,20R,22S)-3,22-dihydroxylanosta-7,24-dien-23-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69011

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