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Concept information

Preferred term

سیتوسپورین E  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O7

inchi

  • InChI=1S/C20H30O7/c1-4-5-6-7-8-9-12-13(11-21)16-20(24,10-14(22)19(2,3)27-16)17-15(12)25-18(23)26-17/h8-9,14-17,21-22,24H,4-7,10-11H2,1-3H3/b9-8+/t14-,15+,16-,17+,20+/m0/s1

inchikey

  • IMQYAWIJNZPDJB-QKWWGZASSA-N

mass

  • 382.453

monoisotopicmass

  • 382.19915

smiles

  • O=C1O[C@@H]2C(=C(CO)[C@H]3[C@]([C@@H]2O1)(O)C[C@H](O)C(O3)(C)C)/C=C/CCCCC

subset

  • 2_STAR

synonym EXACT

  • (3aR,5aS,8S,9aR,9bR)-4-[(E)-hept-1-enyl]-8,9a-dihydroxy-5-(hydroxymethyl)-7,7-dimethyl-5a,8,9,9b-tetrahydro-3aH-[1,3]dioxolo[4,5-]chromen-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214126

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