Concept information
Preferred term
3-o-hydroxyphthioceranoyl-2-o-stearoyl-2'-o-sulfo-alpha,alpha-trehalose
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C70H134O17S
has_functional_parent
has_role
inchi
- InChI=1S/C70H134O17S/c1-11-13-15-17-19-21-23-25-26-28-30-32-34-36-38-40-61(74)84-67-65(63(76)60(49-72)83-70(67)86-69-66(87-88(79,80)81)64(77)62(75)59(48-71)82-69)85-68(78)57(10)47-55(8)45-53(6)43-51(4)41-50(3)42-52(5)44-54(7)46-56(9)58(73)39-37-35-33-31-29-27-24-22-20-18-16-14-12-2/h50-60,62-67,69-73,75-77H,11-49H2,1-10H3,(H,79,80,81)/t50-,51+,52-,53+,54-,55+,56-,57+,58?,59-,60-,62-,63-,64+,65+,66-,67-,69-,70-/m1/s1
inchikey
- VWVPETHFNNBIKR-PNDNKMLWSA-N
mass
- 1279.872
monoisotopicmass
- 1278.93417
smiles
- [C@H]1([C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)OS(=O)(=O)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)OC([C@H](C[C@H](C[C@H](C[C@H](C[C@H](C[C@H](C[C@H](C[C@H](C(O)CCCCCCCCCCCCCCC)C)C)C)C)C)C)C)C)=O)OC(CCCCCCCCCCCCCCCCC)=O
subset
- 3_STAR
synonym EXACT
- 3-O-[(2S,4S,6S,8S,10R,12R,14R,16R)-17-hydroxy-2,4,6,8,10,12,14,16-octamethyldotriacontanoyl]-2-O-octadecanoyl-alpha-D-glucopyranosyl 2-O-sulfo-alpha-D-glucopyranoside
synonym RELATED
- 3-O-[(2S,4S,6S,8S,10R,12R,14R,16R)-17-hydroxy-2,4,6,8,10,12,14,16-octamethyldotriacontanoyl]-2-O-stearoyl-alpha-D-glucopyranosyl 2-O-sulfo-alpha-D-glucopyranoside
- Ac2SGL
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:132145
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