Feedback

(1S)-1,23,25-trihydroxy-24-oxocalciol

Properties

Image

Occurences in reactions

MNX_ID

MNXM739212

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	3

formula

C₂₇H₄₂O₅

charge

mass

446.30322

reference

chebi:47813

InChIKey

ARRIBDAUGOLZSJ-QEEPAQDXSA-N

InChI

InChI=1S/C27H42O5/c1-16(13-24(30)25(31)26(3,4)32)21-10-11-22-18(7-6-12-27(21,22)5)8-9-19-14-20(28)15-23(29)17(19)2/h8-9,16,20-24,28-30,32H,2,6-7,10-15H2,1,3-5H3/b18-8+,19-9-/t16-,20-,21-,22+,23+,24?,27-/m1/s1

SMILES

C=C1/C(=C\C=C2/CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CC(O)C(=O)C(C)(C)O)C[C@@H](O)C[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:47813 chebi:47813	(1S)-1,23,25-trihydroxy-24-oxocalciol 1,23,25-Tov 1,23,25-Trihydroxy-24-oxo-vitamin D3 1,23,25-Trihydroxy-24-oxocholecalciferol 23-hydroxy-24-oxocalcitriol 24-oxo-1alpha,23,25(OH)3D3 24-oxo-1alpha,23,25-trihydroxyvitamin D3 24-oxo-23-hydroxycalcitriol
SLM:000000479 slm:000000479	(1S,23,25)-trihydroxy-24-oxocalciol
bigg.metabolite:CE2207 biggM:CE2207	24-oxo-1alpha,23,25-trihydroxyvitamin D3
biggM:M_CE2207	secondary/obsolete/fantasy identifier