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Chemistry, part 3

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 > triptolide analog

Preferred term

triptolide analog  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30O5

inchi

  • InChI=1S/C21H30O5/c1-12(2)21-15(22)11-14-18(3)8-6-9-19(4,17(23)25-5)13(18)7-10-20(14,24)16(21)26-21/h11-13,16,24H,6-10H2,1-5H3/t13-,16+,18+,19-,20+,21-/m1/s1

inchikey

  • ABKTWBMMVOBXFC-USNCVGSQSA-N

mass

  • 362.466

monoisotopicmass

  • 362.20932

smiles

  • O1[C@H]2[C@@]3(O)C([C@@]4([C@H]([C@](CCC4)(C)C(OC)=O)CC3)C)=CC(=O)[C@@]12C(C)C

subset

  • 2_STAR

synonym EXACT

  • methyl (1aS,1bS,3aR,4R,7aS,9aS)-1b-hydroxy-4,7a-dimethyl-9-oxo-9a-propan-2-yl-2,3,3a,5,6,7-hexahydro-1aH-phenanthro[1,2-b]oxirene-4-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230923

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