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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H44O3
Molecular Weight 416.6365
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of CALCITRIOL

SMILES

[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C3\C[C@@H](O)C[C@H](O)C3=C)[C@H](C)CCCC(C)(C)O

InChI

InChIKey=GMRQFYUYWCNGIN-NKMMMXOESA-N
InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22-,23-,24+,25+,27-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
CALCITRIOL
EP   HSDB   INN   JAN   MART.   MI   ORANGE BOOK   USAN   USP   USP-RS   VANDF   WHO-DD  
INN   USAN  
Official Name English
CALCITRIOL [MART.]
Common Name English
VECTICAL
Brand Name English
CALCITRIOL [VANDF]
Common Name English
ROCALTROL
Brand Name English
CALCIJEX
Brand Name English
CALCITRIOL [USP MONOGRAPH]
Common Name English
CALCITRIOL [EP MONOGRAPH]
Common Name English
(1S,3R,5Z,7E)-9,10-SECOCHOLESTA-5,7,10-TRIENE-1,3,25-TRIOL
Common Name English
CALCITRIOL [USP-RS]
Common Name English
RO-21-5535
Code English
CALCITRIOL [JAN]
Common Name English
RO-215535
Code English
Calcitriol [WHO-DD]
Common Name English
CALCITRIOL [HSDB]
Common Name English
CALCITRIOL [ORANGE BOOK]
Common Name English
calcitriol [INN]
Common Name English
1,25-DIHYDROXY VITAMIN D3
Common Name English
1,25-HYDROXYLATED VITAMIN D
Common Name English
1,25-DIHYDROXYVITAMIN D3
Common Name English
RO 21-5535
Code English
CALCITRIOL [USAN]
Common Name English
CALCITRIOL [MI]
Common Name English
9,10-SECOCHOLESTA-5,7,10(19)-TRIENE-1,3,25-TRIOL, (1.ALPHA.,3.BETA.,5Z,7E)-
Common Name English
(5Z,7E)-9,10-Secocholesta-5,7,10(19)-triene-1α,3β,25-triol
Common Name English
1,25-DIHYDROXYCHOLECALCIFEROL, (1ALPHA)-
Common Name English
Classification Tree Code System Code
NDF-RT N0000006996
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
WHO-VATC QD05AX03
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
NCI_THESAURUS C39713
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
LOINC 1649-3
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
LIVERTOX 140
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
NDF-RT N0000006996
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
WHO-ATC A11CC04
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
NDF-RT N0000006996
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
NDF-RT N0000006996
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
LOINC 14566-4
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
NDF-RT N0000175908
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
WHO-VATC QA11CC04
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
WHO-ATC D05AX03
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
NCI_THESAURUS C1934
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
Code System Code Type Description
IUPHAR
2779
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
ECHA (EC/EINECS)
250-963-8
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
PUBCHEM
5280453
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
SMS_ID
100000092790
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
WIKIPEDIA
CALCITRIOL
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
CHEBI
17823
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
MERCK INDEX
m2917
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY Merck Index
DRUG BANK
DB00136
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
RS_ITEM_NUM
1086301
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
MESH
D002117
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID5022722
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
INN
4393
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
ChEMBL
CHEMBL846
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
DAILYMED
FXC9231JVH
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
DRUG CENTRAL
466
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
NCI_THESAURUS
C330
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
HSDB
3482
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
EVMPD
SUB06047MIG
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
RXCUI
1894
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY RxNorm
FDA UNII
FXC9231JVH
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
LACTMED
Calcitriol
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
CAS
32222-06-3
Created by admin on Fri Dec 15 15:48:11 UTC 2023 , Edited by admin on Fri Dec 15 15:48:11 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of CALCITRIOL
METABOLITE INACTIVE (PARENT)
Structure of CALCITROIC ACID
PARENT (METABOLITE ACTIVE)
Structure of 3.BETA.-D-GLUCOPYRANOSYLCALCITRIOL
PRODRUG (METABOLITE ACTIVE)
Structure of Cholecalciferol
SALT/SOLVATE (PARENT)
Structure of CALCITRIOL MONOHYDRATE
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
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