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Concept information

Preferred term

3بتا،14بتا دی هیدروکسی 6 اکسو A نوررگوستا 7،22 ان 4 اوئیک اسید دلتا لاکتون  

Type

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

Broader concept

charge

  • 0

formula

  • C28H40O5

inchi

  • InChI=1S/C28H40O5/c1-16(2)17(3)7-8-18(4)19-9-10-27(32)21-15-20(29)22-25(6)11-13-26(22,31)23(30)33-28(21,25)14-12-24(19,27)5/h7-8,15-19,22,31-32H,9-14H2,1-6H3/b8-7+/t17-,18+,19+,22-,24+,25-,26-,27-,28+/m0/s1

inchikey

  • HWTADBLONBIKPB-DLYACJOKSA-N

mass

  • 456.623

monoisotopicmass

  • 456.28757

smiles

  • O=C1O[C@]23C(=CC([C@@H]4[C@@]1(O)CC[C@]24C)=O)[C@]5(O)[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC5)(C)CC3

subset

  • 2_STAR

synonym EXACT

  • (1S,4S,7S,8S,12R,15R,16R)-15-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-4,12-dihydroxy-7,16-dimethyl-2-oxapentacyclo[9.7.0.01,7.04,8.012,16]octadec-10-ene-3,9-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216488

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