CHEBI:8629 - Pterosterone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Pterosterone
ChEBI ID CHEBI:8629
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H44O7
Net Charge 0
Average Mass 480.635
Monoisotopic Mass 480.30870
InChI InChI=1S/C27H44O7/c1-14(2)18(28)12-23(32)26(5,33)22-7-9-27(34)16-10-19(29)17-11-20(30)21(31)13-24(17,3)15(16)6-8-25(22,27)4/h10,14-15,17-18,20-23,28,30-34H,6-9,11-13H2,1-5H3/t15-,17-,18-,20+,21-,22-,23+,24+,25+,26+,27+/m0/s1
InChIKey UMMBJCYNGLCGEF-OAUIFJKNSA-N
SMILES CC(C)[C@@H](O)C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing Pterosterone (CHEBI:8629) is a steroid (CHEBI:35341)
Synonym Source
Pterosterone KEGG COMPOUND
Manual Xrefs Databases
C00003670 KNApSAcK
C08838 KEGG COMPOUND
View more database links
Registry Number Type Source
18089-44-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014