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Concept information

Preferred term

actinosporin b  

Type

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

Broader concept

charge

  • 0

formula

  • C25H26O11

inchi

  • InChI=1S/C25H26O11/c1-9-17(27)21(31)22(32)24(35-9)36-13-4-2-3-11-15(13)18(28)12-6-5-10-7-25(34,8-26)23(33)20(30)14(10)16(12)19(11)29/h2-6,9,17,20-24,26-27,30-34H,7-8H2,1H3/t9-,17-,20?,21+,22+,23?,24-,25?/m0/s1

inchikey

  • KKUPFEHKCATSSO-YQNAEIKZSA-N

mass

  • 502.472

monoisotopicmass

  • 502.14751

smiles

  • O=C1C2=C(O[C@@H]3O[C@H]([C@H](O)[C@H]([C@H]3O)O)C)C=CC=C2C(=O)C4=C1C=CC5=C4C(O)C(O)C(C5)(O)CO

subset

  • 2_STAR

synonym EXACT

  • 1,2,3-trihydroxy-3-(hydroxymethyl)-8-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,4-dihydro-1H-benzo[a]anthracene-7,12-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222756

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