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CHEBI:145207 - 13'-carboxy-alpha-tocopherol

ChEBI IDCHEBI:145207
ChEBI Name13'-carboxy-alpha-tocopherol
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FormulaC29H48O4
Net Charge0
Average Mass460.699
Monoisotopic Mass460.35526
SMILESCc1c(C)c2c(c(C)c1O)CC[C@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C(=O)O)O2
InChIInChI=1S/C29H48O4/c1-19(13-9-15-21(3)28(31)32)11-8-12-20(2)14-10-17-29(7)18-16-25-24(6)26(30)22(4)23(5)27(25)33-29/h19-21,30H,8-18H2,1-7H3,(H,31,32)/t19-,20+,21?,29+/m1/s1
InChIKeyNJIUWSABAIXPGI-AXTKCOKSSA-N
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
ChEBI Ontology
Outgoing Relation(s)
13'-carboxy-alpha-tocopherol (CHEBI:145207) is a tocopherol (CHEBI:27013)
Manual XrefsDatabases
HMDB0012555HMDB