CHEBI:80095 - 5,7,24(28)-Ergostatrienol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5,7,24(28)-Ergostatrienol
ChEBI ID CHEBI:80095
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C28H44O
Net Charge 0
Average Mass 396.64840
Monoisotopic Mass 396.33922
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9-10,18,20,22,24-26,29H,3,7-8,11-17H2,1-2,4-6H3/t20-,22+,24-,25+,26?,27+,28-/m1/s1
InChIKey ZEPNVCGPJXYABB-CPGDAPNVSA-N
SMILES CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
ChEBI Ontology
Outgoing 5,7,24(28)-Ergostatrienol (CHEBI:80095) is a ergostanoid (CHEBI:50403)
Manual Xrefs Databases
C15778 KEGG COMPOUND
HMDB0060404 HMDB
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