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Concept information

Preferred term

lsm-5186  

Type

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

Broader concept

charge

  • 0

formula

  • C41H74O7

inchi

  • InChI=1S/C41H74O7/c1-12-14-26(2)21-28(4)23-31(7)36(44)25-35(43)30(6)22-27(3)15-13-16-29(5)39(46)32(8)37(45)24-34-17-19-41(11,47-34)38-18-20-40(10,48-38)33(9)42/h13,16,26-34,37-39,42,45-46H,12,14-15,17-25H2,1-11H3/t26-,27-,28+,29-,30-,31+,32+,33-,34+,37+,38?,39-,40+,41+/m1/s1

inchikey

  • DICYOBFZDAWHJC-DVGTUTCUSA-N

mass

  • 679.024

monoisotopicmass

  • 678.54345

smiles

  • CCC[C@@H](C)C[C@H](C)C[C@H](C)C(=O)CC(=O)[C@H](C)C[C@H](C)CC=C[C@@H](C)[C@H]([C@@H](C)[C@H](C[C@@H]1CC[C@@](O1)(C)C2CC[C@@](O2)(C)[C@@H](C)O)O)O

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:94460

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