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Concept information

Preferred term

butyl xanalterate  

Type

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

Broader concept

charge

  • 0

formula

  • C24H22O7

inchi

  • InChI=1S/C24H22O7/c1-2-3-10-30-23(28)24(29)11-15-14-5-8-17(26)21-16(25)7-4-12(19(14)21)13-6-9-18(27)22(31-24)20(13)15/h4,6-7,9,25,27,29H,2-3,5,8,10-11H2,1H3/t24-/m0/s1

inchikey

  • NAZJNVRQXMZSIG-DEOSSOPVSA-N

mass

  • 422.433

monoisotopicmass

  • 422.13655

smiles

  • O=C1C=2C=3C(=C4C=5C(O[C@](CC5C3CC1)(O)C(=O)OCCCC)=C(O)C=C4)C=CC2O

subset

  • 2_STAR

synonym EXACT

  • butyl 4,7,14-trihydroxy-16-oxo-5-oxapentacyclo[9.7.1.12,6.015,19.010,20]icosa-1(19),2(20),6,8,10,12,14-heptaene-4-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213939

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