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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 > sesquiterpenoid > 13-deoxyarmellide b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > 13-deoxyarmellide b

Preferred term

13-deoxyarmellide b  

Type

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

Broader concept

charge

  • 0

formula

  • C24H31ClO7

inchi

  • InChI=1S/C24H31ClO7/c1-11-17(14(26)7-15(31-5)19(11)25)21(29)32-10-13-6-12-8-22(2,3)20(28)18(12)23(4)9-16(27)24(13,23)30/h6-7,12,16,18,20,26-28,30H,8-10H2,1-5H3/t12-,16-,18-,20-,23-,24+/m1/s1

inchikey

  • CJNLXKYQKWFRHQ-UEXMDZLUSA-N

mass

  • 466.960

monoisotopicmass

  • 466.17583

smiles

  • ClC1=C(OC)C=C(O)C(=C1C)C(=O)OCC2=C[C@H]3[C@H]([C@@H](O)C(C3)(C)C)[C@@]4([C@@]2(O)[C@H](O)C4)C

subset

  • 2_STAR

synonym EXACT

  • [(2R,2aS,4aS,7R,7aS,7bR)-2,2a,7-trihydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-3-yl]methyl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203523

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