CHEBI:20656 - 5α-pregnane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5α-pregnane
ChEBI ID CHEBI:20656
ChEBI ASCII Name 5alpha-pregnane
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000064622563
Download Molfile XML SDF
Formula C21H36
Net Charge 0
Average Mass 288.51054
Monoisotopic Mass 288.28170
InChI InChI=1S/C21H36/c1-4-15-9-11-18-17-10-8-16-7-5-6-13-20(16,2)19(17)12-14-21(15,18)3/h15-19H,4-14H2,1-3H3/t15-,16+,17-,18-,19-,20-,21+/m0/s1
InChIKey JWMFYGXQPXQEEM-GCOKGBOCSA-N
SMILES [H][C@]1(CC)CC[C@@]2([H])[C@]3([H])CC[C@@]4([H])CCCC[C@]4(C)[C@@]3([H])CC[C@]12C
ChEBI Ontology
Outgoing 5α-pregnane (CHEBI:20656) is a C21-steroid (CHEBI:61313)
5α-pregnane (CHEBI:20656) is a pregnane (CHEBI:8386)
Incoming 11,21-dioxoprogesterone (CHEBI:78601) has parent hydride 5α-pregnane (CHEBI:20656)
21-dehydrocortisol (CHEBI:78595) has parent hydride 5α-pregnane (CHEBI:20656)
21-dehydrocortisone (CHEBI:78596) has parent hydride 5α-pregnane (CHEBI:20656)
3α,17α-dihydroxy-5α-pregnan-11,20-dione (CHEBI:233651) has parent hydride 5α-pregnane (CHEBI:20656)
3-hydroxy-5α-pregnan-20-one (CHEBI:50170) has parent hydride 5α-pregnane (CHEBI:20656)
5α-dihydrodeoxycorticosterone (CHEBI:81468) has parent hydride 5α-pregnane (CHEBI:20656)
5α-pregan-20β-ol-3-one (CHEBI:78594) has parent hydride 5α-pregnane (CHEBI:20656)
5α-pregnan-11β-ol-3,20-dione (CHEBI:233590) has parent hydride 5α-pregnane (CHEBI:20656)
5α-pregnan-3α,11β-diol-20-one (CHEBI:233592) has parent hydride 5α-pregnane (CHEBI:20656)
5α-pregnan-3,11,20-trione (CHEBI:233589) has parent hydride 5α-pregnane (CHEBI:20656)
5α-pregnane-3,20-dione (CHEBI:28952) has parent hydride 5α-pregnane (CHEBI:20656)
hookerianamide H (CHEBI:66020) has parent hydride 5α-pregnane (CHEBI:20656)
hookerianamide I (CHEBI:66021) has parent hydride 5α-pregnane (CHEBI:20656)
hookerianamide J (CHEBI:66022) has parent hydride 5α-pregnane (CHEBI:20656)
isosarcodine (CHEBI:228286) has parent hydride 5α-pregnane (CHEBI:20656)
sarcodine (CHEBI:228287) has parent hydride 5α-pregnane (CHEBI:20656)
sarcorine (CHEBI:228274) has parent hydride 5α-pregnane (CHEBI:20656)
IUPAC Name
5α-pregnane
Synonym Source
allopregnane ChemIDplus
Registry Numbers Types Sources
2502007 Beilstein Registry Number Beilstein
641-85-0 CAS Registry Number NIST Chemistry WebBook
641-85-0 CAS Registry Number ChemIDplus
Last Modified
19 December 2023