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CHEBI:5513 - Gnididilatin

ChEBI IDCHEBI:5513
ChEBI NameGnididilatin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC37H48O10
Net Charge0
Average Mass652.781
Monoisotopic Mass652.32475
SMILES[H][C@@]12C=C(C)C(=O)[C@@]1(O)[C@H](O)[C@@]1(CO)O[C@@]1([H])[C@@]1([H])[C@H]3OC4(CCCCCCCCC)O[C@@]3(C(=C)C)[C@H](OC(=O)c3ccccc3)[C@@H](C)[C@]21O4
InChIInChI=1S/C37H48O10/c1-6-7-8-9-10-11-15-18-34-45-30-26-29-33(20-38,44-29)32(41)35(42)25(19-22(4)27(35)39)37(26,47-34)23(5)28(36(30,46-34)21(2)3)43-31(40)24-16-13-12-14-17-24/h12-14,16-17,19,23,25-26,28-30,32,38,41-42H,2,6-11,15,18,20H2,1,3-5H3/t23-,25-,26+,28-,29+,30-,32-,33+,34?,35-,36+,37+/m1/s1
InChIKeyMAKBJYBPYTYDBJ-OMLIOTFFSA-N
ChEBI Ontology
Outgoing Relation(s)
Gnididilatin (CHEBI:5513) is a diterpenoid (CHEBI:23849)
Synonym  Source
GnididilatinKEGG COMPOUND
Manual XrefsDatabases
C09101KEGG COMPOUND
C00003432KNApSAcK
Registry NumbersSources
CAS:60195-69-9KEGG COMPOUND