CHEBI:9049 - Schottenol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Schottenol
ChEBI ID CHEBI:9049
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C29H50O
Net Charge 0
Average Mass 414.708
Monoisotopic Mass 414.38617
InChI InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h11,19-23,25-27,30H,7-10,12-18H2,1-6H3/t20-,21-,22+,23+,25-,26+,27+,28+,29-/m1/s1
InChIKey YSKVBPGQYRAUQO-UZSYLJJSSA-N
SMILES CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
ChEBI Ontology
Outgoing Schottenol (CHEBI:9049) has parent hydride stigmastane (CHEBI:26773)
Schottenol (CHEBI:9049) is a steroid (CHEBI:35341)
Synonym Source
Schottenol KEGG COMPOUND
Manual Xrefs Databases
C00003671 KNApSAcK
C08839 KEGG COMPOUND
View more database links
Registry Number Type Source
521-03-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014