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Concept information

Preferred term

asperdichrome  

Type

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

Broader concept

charge

  • 0

formula

  • C32H30O14

inchi

  • InChI=1S/C32H30O14/c1-12-10-14(33)22-25(36)20-16(6-5-7-17(20)45-31(22,27(12)38)29(40)42-3)44-19-9-8-18-21(24(19)35)26(37)23-15(34)11-13(2)28(39)32(23,46-18)30(41)43-4/h5-9,12-13,27-28,35-39H,10-11H2,1-4H3/t12-,13-,27-,28+,31+,32+/m0/s1

inchikey

  • ZWKHHTDRHMFWDL-RHBKKXGBSA-N

mass

  • 638.578

monoisotopicmass

  • 638.16356

smiles

  • O=C1C2=C(O)C3=C(O)C(OC4=C5C(O)=C6C(=O)C[C@H](C)[C@@H]([C@]6(C(=O)OC)OC5=CC=C4)O)=CC=C3O[C@@]2(C(=O)OC)[C@H](O)[C@H](C1)C

subset

  • 2_STAR

synonym EXACT

  • methyl (3S,4R,4aR)-7-[[(5S,6S,10aR)-5,9-dihydroxy-10a-methoxycarbonyl-6-methyl-8-oxo-6,7-dihydro-5H-xanthen-1-yl]oxy]-4,8,9-trihydroxy-3-methyl-1-oxo-3,4-dihydro-2H-xanthene-4a-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217347

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