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Concept information

Preferred term

lysolipin i  

Type

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

Broader concept

charge

  • 0

formula

  • C29H24ClNO11

inchi

  • InChI=1S/C29H24ClNO11/c1-31-28(36)14-10(19(33)29(31)39-4)7-11-13(20(14)34)15-16-25(22(11)37-2)40-8-41-26(16)27-17(21(15)35)18(32)9-5-6-12(30)24(38-3)23(9)42-27/h5-7,19,22,25,29,33-35H,8H2,1-4H3/t19-,22+,25-,29-/m0/s1

inchikey

  • NEOMIZJYHXSRLV-ZIITWBKLSA-N

mass

  • 597.960

monoisotopicmass

  • 597.10379

smiles

  • ClC1=C(OC)C=2OC3=C4OCO[C@H]5C4=C(C6=C(O)C=7C(=O)N([C@@H](OC)[C@H](C7C=C6[C@H]5OC)O)C)C(=C3C(C2C=C1)=O)O

subset

  • 2_STAR

synonym EXACT

  • (7S,8S,12R,13S)-22-chloro-3,8,28-trihydroxy-7,12,21-trimethoxy-6-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.02,11.04,9.013,29.018,27.020,25]nonacosa-1(29),2,4(9),10,17,20(25),21,23,27-nonaene-5,26-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201319

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