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Concept information

Preferred term

Engyodontochone F  

Type

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

Broader concept

charge

  • 0

formula

  • C33H30O13

inchi

  • InChI=1S/C33H30O13/c1-13-10-32-11-15-9-18(36)25-19(37)12-33(31(43)44-3,20(38)7-8-21(39)40)46-29(25)23(15)22(13)27(41)26(32)28(42)24-16(5-4-6-17(24)35)30(32)45-14(2)34/h4-6,9-10,20,22,30,35-36,38,42H,7-8,11-12H2,1-3H3,(H,39,40)/t20?,22-,30-,32-,33+/m0/s1

inchikey

  • XJOGORFZWPNKFH-XPMXPIDHSA-N

mass

  • 634.590

monoisotopicmass

  • 634.16864

smiles

  • O=C1C2=C(O)C3=C(O)C=CC=C3[C@@H]([C@]24C=C([C@H]1C5=C6O[C@@](C(=O)OC)(C(O)CCC(=O)O)CC(C6=C(O)C=C5C4)=O)C)OC(=O)C

subset

  • 2_STAR

synonym EXACT

  • 4-[(1R,9R,13S,23S)-23-acetyloxy-5,16,18-trihydroxy-9-methoxycarbonyl-25-methyl-7,14-dioxo-10-oxahexacyclo[11.10.2.01,15.03,12.06,11.017,22]pentacosa-3,5,11,15,17(22),18,20,24-octaen-9-yl]-4-hydroxybutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227894

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