PEFCALCITOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H34F5NO4
Molecular Weight	519.5445
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC=C([C@H](C)OCC(=O)NCC(F)(F)C(F)(F)F)[C@@]1(C)CCC\C2=C/C=C3/C[C@@H](O)C[C@H](O)C3=C

InChI

InChIKey=SVCSMAZYWOQCBW-NVJMFHFGSA-N

InChI=1S/C26H34F5NO4/c1-15-18(11-19(33)12-22(15)34)7-6-17-5-4-10-24(3)20(8-9-21(17)24)16(2)36-13-23(35)32-14-25(27,28)26(29,30)31/h6-8,16,19,21-22,33-34H,1,4-5,9-14H2,2-3H3,(H,32,35)/b17-6+,18-7-/t16-,19+,21-,22-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H34F5NO4
Molecular Weight	519.5445
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 04:18:37 UTC 2023` Edited by `admin` on `Sat Dec 16 04:18:37 UTC 2023`
Record UNII	KT5224XSHW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PEFCALCITOL

Official Name

English

PEFCALCITOL [USAN]

Common Name

English

ACETAMIDE, 2-((1S)-1-((3AS,7E,7AS)-7-((2Z)-((3S,5R)-3,5-DIHYDROXY-2-METHYLENECYCLOHEXYLIDENE)ETHYLIDENE)-3A,4,5,6,7,7A-HEXAHYDRO-3A-METHYL-1H-INDEN-3-YL)ETHOXY)-N-(2,2,3,3,3-PENTAFLUOROPROPYL)-

Common Name

English

2-(((1S,3R,5Z,7E,20S)-1,3-DIHYDROXY-9,10-SECOPREGNA-5,7,10(19),16-TETRAEN-20-YL)OXY)-N-(2,2,3,3,3-PENTAFLUOROPROPYL)ACETAMIDE

Common Name

English

M-518101

Code

English

M518101

Code

English

Pefcalcitol [WHO-DD]

Common Name

English

pefcalcitol [INN]

Common Name

English

PEFCALCITOL [JAN]

Common Name

English

M5181

Code

English

M-5181

Code

English

Code System Code Type Description

DRUG BANK

DB11786