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Concept information

Preferred term

gymnodrimane b  

Type

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

Broader concept

charge

  • 0

formula

  • C16H24O5

inchi

  • InChI=1S/C16H24O5/c1-15(2)11-5-4-9(13(18)19)10-8-21-14(20-3)16(10,11)7-6-12(15)17/h4,10-12,14,17H,5-8H2,1-3H3,(H,18,19)/t10-,11-,12-,14-,16-/m0/s1

inchikey

  • VNSNUUUFNWTZOA-HNRKBYSSSA-N

mass

  • 296.363

monoisotopicmass

  • 296.16237

smiles

  • O=C(O)C1=CC[C@H]2C([C@@H](O)CC[C@@]32[C@H]1CO[C@@H]3OC)(C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,3aR,6aS,8S,10aR)-8-hydroxy-1-methoxy-7,7-dimethyl-1,3,3a,6,6a,8,9,10-octahydrobenzo[d][2]benzouran-4-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214632

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