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Content language

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Concept information

ترکیب اکسیژن ارگانیک > اسپیکارین دی

Preferred term

اسپیکارین دی  

Type

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

Broader concept

charge

  • 0

formula

  • C31H32O15

has_functional_parent

inchi

  • InChI=1S/C31H32O15/c1-11-19-10-39-25(21(19)26(42-15(5)34)29(44-17(7)36)23(11)40-13(3)32)27-22-20(31(38-9)46-27)12(2)24(41-14(4)33)30(45-18(8)37)28(22)43-16(6)35/h25,27,31H,10H2,1-9H3/t25-,27+,31-/m1/s1

inchikey

  • NUECMCRANXGGPO-YHZWXPKMSA-N

mass

  • 644.582

monoisotopicmass

  • 644.17412

smiles

  • O=C(OC1=C(OC(=O)C)C(=C2[C@H](OC)O[C@@H](C2=C1OC(=O)C)[C@@H]3OCC=4C3=C(OC(=O)C)C(OC(=O)C)=C(OC(=O)C)C4C)C)C

subset

  • 2_STAR

synonym EXACT

  • [(1R)-6,7-diacetyloxy-4-methyl-1-[(1S,3R)-5,6,7-triacetyloxy-3-methoxy-4-methyl-1,3-dihydro-2-benzouran-1-yl]-1,3-dihydro-2-benzouran-5-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227521

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