Concept information
Preferred term
(2s,3s)-2-[(14r)-14-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypentadecyl]-4-methylidene-5-oxooxolane-3-carboxylic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C39H66O20
inchi
- InChI=1S/C39H66O20/c1-19(14-12-10-8-6-4-3-5-7-9-11-13-15-21-25(35(50)51)20(2)36(52)55-21)54-39-34(59-38-33(49)30(46)27(43)23(17-41)57-38)31(47)28(44)24(58-39)18-53-37-32(48)29(45)26(42)22(16-40)56-37/h19,21-34,37-49H,2-18H2,1H3,(H,50,51)/t19-,21+,22?,23?,24?,25+,26?,27?,28?,29?,30?,31?,32?,33?,34?,37?,38?,39?/m1/s1
inchikey
- ADYRTTQRSHFPFG-OYNPUQFGSA-N
mass
- 854.937
monoisotopicmass
- 854.41474
smiles
- O=C1O[C@@H](CCCCCCCCCCCCC[C@H](OC2OC(C(O)C(C2OC3OC(C(O)C(C3O)O)CO)O)COC4OC(C(O)C(C4O)O)CO)C)[C@H](C1=C)C(=O)O
subset
- 2_STAR
synonym EXACT
- (2S,3S)-2-[(14R)-14-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypentadecyl]-4-methylidene-5-oxooxolane-3-carboxylic acid
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:202326
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