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CHEBI:176285 - Notoginsenoside T2

Default Structure
ChEBI IDCHEBI:176285
ChEBI NameNotoginsenoside T2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H62O10
Net Charge0
Average Mass666.893
Monoisotopic Mass666.43430
SMILESCOC(/C=C(\C)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3O)CC12C)C1OC1(C)C
InChIInChI=1S/C37H62O10/c1-18(14-21(44-9)31-34(4,5)47-31)19-10-13-36(7)26(19)20(39)15-24-35(6)12-11-25(40)33(2,3)30(35)22(16-37(24,36)8)45-32-29(43)28(42)27(41)23(17-38)46-32/h14,19-32,38-43H,10-13,15-17H2,1-9H3/b18-14+
InChIKeyUWWGFPDRXDYTKI-NBVRZTHBSA-N
ChEBI Ontology
Outgoing Relation(s)
Notoginsenoside T2 (CHEBI:176285) is a triterpenoid (CHEBI:36615)
IUPAC Name 
2-[[17-[(E)-4-(3,3-dimethyloxiran-2-yl)-4-methoxybut-2-en-2-yl]-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
HMDB0039050HMDB