CHEBI:63844 - 4-carboxyzymosterol

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ChEBI Name 4-carboxyzymosterol
ChEBI ID CHEBI:63844
Definition A steroid acid, the 4-carboxy derivative of zymosterol.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H44O3
Net Charge 0
Average Mass 428.64720
Monoisotopic Mass 428.32905
InChI InChI=1S/C28H44O3/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(26(30)31)24(29)14-16-28(23,5)22(19)13-15-27(20,21)4/h7,18,20-21,23-25,29H,6,8-16H2,1-5H3,(H,30,31)/t18-,20-,21+,23+,24+,25?,27-,28-/m1/s1
InChIKey JHIWIFRQJXLNEU-XSJUYMIFSA-N
SMILES [H][C@@]12CCC3=C(CC[C@]4(C)[C@]([H])(CC[C@@]34[H])[C@H](C)CCC=C(C)C)[C@@]1(C)CC[C@H](O)C2C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-carboxyzymosterol (CHEBI:63844) has functional parent zymosterol (CHEBI:18252)
4-carboxyzymosterol (CHEBI:63844) is a 3β-sterol (CHEBI:35348)
4-carboxyzymosterol (CHEBI:63844) is a monocarboxylic acid (CHEBI:25384)
4-carboxyzymosterol (CHEBI:63844) is a steroid acid (CHEBI:47891)
4-carboxyzymosterol (CHEBI:63844) is conjugate acid of 4-carboxyzymosterol(1−) (CHEBI:64967)
Incoming 4-carboxyzymosterol(1−) (CHEBI:64967) is conjugate base of 4-carboxyzymosterol (CHEBI:63844)
IUPAC Name
3β-hydroxy-5α-cholesta-8,24-diene-4-carboxylic acid
Synonym Source
4-carboxy-5α-cholesta-8(9),24-dien-3β-ol ChEBI
Last Modified
05 December 2013