Concept information
Preferred term
کندریلاسترول 3 [گلوکوزیل (1 > 2) گلوکوزیل (1 > 2) گلوکوزید]
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C47H78O16
has_parent_hydride
inchi
- InChI=1S/C47H78O16/c1-7-24(22(2)3)9-8-23(4)28-12-13-29-27-11-10-25-18-26(14-16-46(25,5)30(27)15-17-47(28,29)6)58-44-41(38(55)35(52)32(20-49)60-44)63-45-42(39(56)36(53)33(21-50)61-45)62-43-40(57)37(54)34(51)31(19-48)59-43/h8-9,11,22-26,28-45,48-57H,7,10,12-21H2,1-6H3/b9-8+
inchikey
- GKJMLOMZBLJNRX-CMDGGOBGSA-N
mass
- 899.125
monoisotopicmass
- 898.52899
smiles
- O(C1CC2C(C3C(C4C(C(CC4)C(C)/C=C/C(C(C)C)CC)(CC3)C)=CC2)(CC1)C)C5OC(C(O)C(O)C5OC6OC(C(O)C(O)C6OC7OC(C(O)C(O)C7O)CO)CO)CO
subset
- 2_STAR
synonym EXACT
- 2-[2-[2-[[17-[(E)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:169790
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