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Concept information

Preferred term

lsm-6365  

Type

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

Broader concept

charge

  • 0

formula

  • C33H47NO13

inchi

  • InChI=1S/C33H47NO13/c1-18-10-8-6-4-3-5-7-9-11-21(45-32-30(39)28(34)29(38)19(2)44-32)15-25-27(31(40)41)22(36)17-33(42,47-25)16-20(35)14-24-23(46-24)12-13-26(37)43-18/h3-9,11-13,18-25,27-30,32,35-36,38-39,42H,10,14-17,34H2,1-2H3,(H,40,41)/t18?,19-,20?,21?,22?,23?,24?,25?,27?,28+,29-,30+,32+,33?/m1/s1

inchikey

  • NCXMLFZGDNKEPB-SVRVJHCCSA-N

mass

  • 665.726

monoisotopicmass

  • 665.30474

smiles

  • C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC2CC3C(C(CC(O3)(CC(CC4C(O4)C=CC(=O)OC(CC=CC=CC=CC=C2)C)O)O)O)C(=O)O)O)N)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:95104

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