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Concept information

Preferred term

کلروتئولید A  

Type

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

charge

  • 0

formula

  • C30H35ClO11

inchi

  • InChI=1S/C30H35ClO11/c1-6-7-8-9-10-11-18-15-40-29(36)28(31)21(37-3)14-26(24(34)38-4,16-27(18,28)25(35)39-5)30(29)41-20-13-17(2)12-19(32)22(20)23(33)42-30/h12-15,32,36H,6-11,16H2,1-5H3/t26-,27+,28-,29-,30+/m0/s1

inchikey

  • BFLCOAQRRKCNJI-PBIKNJLJSA-N

mass

  • 607.050

monoisotopicmass

  • 606.18679

smiles

  • Cl[C@]12C(OC)=C[C@]3(C(=O)OC)[C@]4([C@]1(OC=C([C@@]2(C(=O)OC)C3)CCCCCCC)O)OC(=O)C=5C(O)=CC(=CC5O4)C

subset

  • 2_STAR

synonym EXACT

  • dimethyl (1'S,2R,3'R,7'R,8'R)-8'-chloro-6'-heptyl-3',5-dihydroxy-9'-methoxy-7-methyl-4-oxospiro[1,3-benzodioxine-2,2'-4-oxatricyclo[5.3.1.03,8]undeca-5,9-diene]-1',7'-dicarboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:205971

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