Small Molecule calcitriol

URN urn:agi-cas:32222-06-3
Total Entities 1
Connectivity 5118
Name calcitriol
Class Endogenous compound
Molecular Weight 416.646000
XLogP 6.745000

ChildConcepts 5,6-trans-25-hydroxycholecalciferol

Pathway Ca2+ Reabsorption Decline in Intestine
Osteoblast Function Decline in Gout
PAPA Syndrome
Blau Syndrome
Ca2+ Reabsorption Decline in Kidney
Hyperparathyroidism, Secondary Effect
Ca2+ Absorption Decline in Intestine in Osteoporosis
Prostate Cancer
Ions Reabsorption Dysregulation in Nephrolithiasis
Ca2+ Reabsorption Dysregulation in Urolithiasis
Biosynthesis of Cholesterol
Anti-psoriatic drugs influence PPARG signaling

MedScan ID 1198576

Alias 1,25(OH)2 vitamin D
20-epi-1alpha,25-dihydroxycholecaliferol
32222-06-3
roical
citrihexal
bonky
1-alpha,25-Dihydroxyvitamin D3
1alpha,25(OH)2D3
Renatriol
toptriol
kosteo
DM200
1-hydroxylated 25-hydroxyvitamin-D3
66772-14-3
1,25 dihydroxy cholecalciferol
hitrol
(3H)1,25(OH)2D3
Vitamin D3 derivative 1,25-dihydroxyvitamin D3
1,25-dihydroxyvitamin D3
(1alpha,3beta,5Z,7E)-9,10-Secocholesta-5,7,10(19)-triene-1,3,25-triol
Bocatriol
Sitriol
lemytriol
alpha 25-dihydroxyvitamin D3
ecatrol f
vitamin D 1,25(OH)2D3
Calcitriolum
kolkatriol
1a,25-dihydroxycholecalciferol
9,10 secocholesta 5,7,10(19) triene 1alpha,3beta,25 triol
1,25 dihydrocholecalciferol
1alpha,25-Dihydroxyvitamin D
1-alfa,25-dihydroxycholecalciferol
1-alpha,-1,25-Dihydroxyvitamin D3
rolsical
Osteotriol
Soltriol
1alpha,25 dihydroxycalciferol
1,25-dihydroxycalciferol
cicarol
(5Z,7E)-9,10-Secocholesta-5,7,10(19)-triene-1-alpha,3-beta,25-triol
alpha 25-dihydroxycholecalciferol
rexamat
1,25(OH)(2)-Vitamin D(3)
Calcijex
1 alpha,25-dihydroxycholecalciferol
1,25-DHCC
1-alpha-25-DihydroxyvitaminD3
vectical
DN-101
1alpha,25(OH)(2)-vitamin D(3)
1,25D
Difix
ecatrol
CCRIS 5522
25 dihydroxycholecalciferol
1,25(OH)2D
Calcitriol KyraMed
Decostriol
HSDB 3482
cabone
25-dihydroxyvitamin D
1(gr a),25-dihydroxyvitamin D3
EINECS 250-963-8
poscal
RO 215535
U 49562
1alpha 25-Dihydroxy-Vitamin D-3
1(gr a),25-dihydroxycholecalciferol
1a,25-(OH)2D3
meditrol
RO 21-5535
1,25-Dihydroxycholecaliferol
1,25D3
Calcitriol
125338-24-1
[3H]1,25-dihydroxycholecalciferol
colecalciferol 1,25 diol
[3H]1,25(OH)2D3
1,25(OH2)D3
Topitriol
25-dihydroxyvitamin
1,25-Dihydroxyvitamin D
tariol
Rocaltrol
25[OH]2 vitamin D3
9,10-Seco(5Z,7E)-5,7,10(19)-cholestatriene-1alpha,3beta,25-triol
Calcitriol-Nefro
1,25-dihydroxyvitamin
1,25-dihydroxyvitamin D3 (calcitriol)
Tirocal
1-25 vitamin D3
caraben sc
1,25 dihydroxycolecalciferol
[3H]calcitriol
1,25-dihydroxy vitamin D3
1,25-dihydroxycholecalciferol
Silkis
1 alpha,25-dihydroxycolecalciferol
triocalcit

CAS ID 32222-06-3
1000873-74-4
125338-24-1
69878-52-0

Reaxys ID 11327511
2065596
2065597
2065598
2065599
2227646
2227647
2341008
2341009
2512362
2512363
2512364
3656842
4718471
5307209
5485108
5771818
5771819
5771820

ChEBI ID 17823

PharmaPendium ID Calcitriol

HMDB ID HMDB01903

KEGG ID C01673

InChIKey GMRQFYUYWCNGIN-NKMMMXOESA-N

Molecular Formula C27H44O3

PubChem SID 134999639

PubChem CID 5280453

XLogP-AA 5.1

IUPAC Name (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylene-cyclohexane-1,3-diol

Rotatable Bond Count 6