CALCIPOTRIOL, 24R-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H40O3
Molecular Weight	412.6047
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure Search

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)\C=C\[C@H](O)C4CC4

InChI

InChIKey=LWQQLNNNIPYSNX-CIJZWTHJSA-N

InChI=1S/C27H40O3/c1-17(6-13-25(29)20-8-9-20)23-11-12-24-19(5-4-14-27(23,24)3)7-10-21-15-22(28)16-26(30)18(21)2/h6-7,10,13,17,20,22-26,28-30H,2,4-5,8-9,11-12,14-16H2,1,3H3/b13-6+,19-7+,21-10-/t17-,22-,23-,24+,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H40O3
Molecular Weight	412.6047
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	3
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:39:54 UTC 2023` Edited by `admin` on `Sat Dec 16 01:39:54 UTC 2023`
Record UNII	TYF37XV46I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CALCIPOTRIOL, 24R-

Common Name

English

24-EPI--CALCIPOTRIOL

Common Name

English

9,10-SECOCHOLA-5,7,10(19),22-TETRAENE-1,3,24-TRIOL, 24-CYCLOPROPYL-, (1.ALPHA.,3.BETA.,5Z,7E,22E,24R)-

Common Name

English

PRI 2202

Code

English

24R-CALCIPOTRIENE

Common Name

English

24R-CALCIPOTRIOL

Common Name

English

CALCIPOTRIENE IMPURITY D [USP IMPURITY]

Common Name

English

1,3-CYCLOHEXANEDIOL, 5-((2E)-2-((1R,3AS,7AR)-1-((1R,2E,4R)-4-CYCLOPROPYL-4-HYDROXY-1-METHYL-2-BUTEN-1-YL)OCTAHYDRO-7A-METHYL-4H-INDEN-4-YLIDENE)ETHYLIDENE)-4-METHYLENE-, (1S,3S,5Z)-

Common Name

English

(5Z,7E,22E,24R)-24-CYCLOPROPYL-9,10-SECOCHOLA-5,7,10(19),22-TETRAENE-1.ALPHA.,3.BETA.,24-TRIOL

Common Name

English

CALCIPOTRIOL MONOHYDRATE IMPURITY D [EP IMPURITY]

Common Name

English

PRI-2202

Code

English

CALCIPOTRIOL IMPURITY D [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

TYF37XV46I

Created by admin on Sat Dec 16 01:39:54 UTC 2023 , Edited by admin on Sat Dec 16 01:39:54 UTC 2023

PRIMARY

PUBCHEM

9547353

Created by admin on Sat Dec 16 01:39:54 UTC 2023 , Edited by admin on Sat Dec 16 01:39:54 UTC 2023

PRIMARY

CAS

112827-99-3

Created by admin on Sat Dec 16 01:39:54 UTC 2023 , Edited by admin on Sat Dec 16 01:39:54 UTC 2023

PRIMARY

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