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CHEBI:204312 - GEX1Q5

ChEBI IDCHEBI:204312
ChEBI NameGEX1Q5
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H40O6
Net Charge0
Average Mass424.578
Monoisotopic Mass424.28249
SMILESC/C(=C\C=C\[C@@H](C)C[C@@]1(C)O[C@@H]1[C@H](C)[C@@H](O)[C@@H](C)O)[C@H]1O[C@@H](CC(=O)O)CC[C@@H]1C
InChIInChI=1S/C24H40O6/c1-14(13-24(6)23(30-24)17(4)21(28)18(5)25)8-7-9-15(2)22-16(3)10-11-19(29-22)12-20(26)27/h7-9,14,16-19,21-23,25,28H,10-13H2,1-6H3,(H,26,27)/b8-7+,15-9+/t14-,16+,17-,18-,19-,21-,22-,23-,24-/m1/s1
InChIKeyTVGPUJOEKQVGKN-CMTJFJBNSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (12523818)
ChEBI Ontology
Outgoing Relation(s)
GEX1Q5 (CHEBI:204312) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
2-[(2R,5S,6S)-6-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3R,4R)-3,4-dihydroxypentan-2-yl]-2-methyloxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-5-methyloxan-2-yl]acetic acid
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