Concept information
Preferred term
6,6'-oxybis(1,3,8-trihydroxy-2-((s)-1-hydroxyhexyl)anthracene-9,10-dione)
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C40H38O13
inchi
- InChI=1S/C40H38O13/c1-3-5-7-9-23(41)33-27(45)15-21-31(39(33)51)37(49)29-19(35(21)47)11-17(13-25(29)43)53-18-12-20-30(26(44)14-18)38(50)32-22(36(20)48)16-28(46)34(40(32)52)24(42)10-8-6-4-2/h11-16,23-24,41-46,51-52H,3-10H2,1-2H3/t23-,24-/m0/s1
inchikey
- IBUCESIIJVZXSR-ZEQRLZLVSA-N
mass
- 726.731
monoisotopicmass
- 726.23124
smiles
- O=C1C2=C(O)C(=C(O)C=C2C(=O)C=3C1=C(O)C=C(OC4=CC(O)=C5C(=O)C=6C(O)=C([C@@H](O)CCCCC)C(=CC6C(C5=C4)=O)O)C3)[C@@H](O)CCCCC
subset
- 2_STAR
synonym EXACT
- 1,3,8-trihydroxy-2-[(1S)-1-hydroxyhexyl]-6-[4,5,7-trihydroxy-6-[(1S)-1-hydroxyhexyl]-9,10-dioxoanthracen-2-yl]oxyanthracene-9,10-dione
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:210542
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