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Concept information

ترکیب اکسیژن ارگانیک > تالاروکتال بی

Preferred term

تالاروکتال بی  

Type

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

charge

  • 0

formula

  • C34H30O12

inchi

  • InChI=1S/C34H30O12/c1-10-6-15(37)19-23-16(10)25(38)24-29(44-13(4)35)33(23,9-43-30(19)39)28-27-21-20-18(14(36)7-11(2)22(20)34(24,28)41-5)31(40)45-26(21)17-12(3)8-42-32(17)46-27/h6-7,12,17,24,26,28-29,32,36-37H,8-9H2,1-5H3/t12-,17-,24-,26-,28+,29-,32+,33-,34+/m0/s1

inchikey

  • SVOQJMLNJOHGBN-NPZFWSCHSA-N

mass

  • 630.602

monoisotopicmass

  • 630.17373

smiles

  • O=C1O[C@@H]2C3=C(O[C@@H]4[C@H]2[C@H](CO4)C)[C@@H]5[C@@]67C=8C(C(=O)OC6)=C(O)C=C(C8C([C@H]([C@@]5(C=9C3=C1C(O)=CC9C)OC)[C@@H]7OC(=O)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R,13S,14S,22S,23S,24R,27R,31S)-8,18-dihydroxy-14-methoxy-10,16,24-trimethyl-6,12,20-trioxo-5,21,26,28-tetraoxanonacyclo[13.13.2.13,7.13,13.02,14.019,30.022,29.023,27.011,32]dotriaconta-1(29),7,9,11(32),15(30),16,18-heptaen-31-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212264

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