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CHEBI:81367 - Cryptogenin

ChEBI IDCHEBI:81367
ChEBI NameCryptogenin
Stars
DownloadsMolfile
FormulaC27H42O4
Net Charge0
Average Mass430.629
Monoisotopic Mass430.30831
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC(=O)[C@]1([H])[C@H](C)C(=O)CC[C@@H](C)CO
InChIInChI=1S/C27H42O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-22,25,28-29H,5,7-15H2,1-4H3/t16-,17-,19+,20-,21+,22+,25+,26+,27+/m1/s1
InChIKeyGDKGOXUWEBGZBY-WQTURIIHSA-N
ChEBI Ontology
Outgoing Relation(s)
Cryptogenin (CHEBI:81367) is a cholanoid (CHEBI:36078)
Synonym  Source
KryptogeninKEGG COMPOUND
Manual XrefsDatabases
C17891KEGG COMPOUND
Registry NumbersSources
CAS:468-99-5KEGG COMPOUND