Concept information
Preferred term
کوچلیوکینول
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C31H46O8
inchi
- InChI=1S/C31H46O8/c1-9-16(2)24(34)18(4)19-14-20(33)23-25(35)26-29(7)12-10-21(28(5,6)36)38-22(29)11-13-30(26,8)39-27(23)31(19,37)15-17(3)32/h14,16,18,21-22,25-26,35-37H,9-13,15H2,1-8H3/t16-,18-,21+,22+,25+,26+,29-,30+,31-/m0/s1
inchikey
- ZCSZZICIPVOPHV-KBOMQJRSSA-N
mass
- 546.701
monoisotopicmass
- 546.31927
smiles
- O=C1C2=C(O[C@@]3(CC[C@@H]4[C@@]([C@H]3[C@@H]2O)(CC[C@@H](O4)C(O)(C)C)C)C)[C@](O)(CC(=O)C)C(=C1)[C@@H](C(=O)[C@H](CC)C)C
subset
- 2_STAR
synonym EXACT
- (3R,4aR,6aR,8S,12S,12aS,12bR)-8,12-dihydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-9-[(2S,4S)-4-methyl-3-oxohexan-2-yl]-8-(2-oxopropyl)-1,2,3,4a,5,6,12,12a-octahydropyrano[3,2-a]xanthen-11-one
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:208363
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