25-HYDROXYCHOLECALCIFEROL, 5-TRANS-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H44O2
Molecular Weight	400.6371
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 25-HYDROXYCHOLECALCIFEROL, 5-TRANS-

Structure Search

SMILES

[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C3/C[C@@H](O)CCC3=C)[C@H](C)CCCC(C)(C)O

InChI

InChIKey=JWUBBDSIWDLEOM-WIFPIRAHSA-N

InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12+/t20-,23+,24-,25+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H44O2
Molecular Weight	400.6371
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 01:53:38 UTC 2023` Edited by `admin` on `Sat Dec 16 01:53:38 UTC 2023`
Record UNII	SN331791VY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

25-HYDROXYCHOLECALCIFEROL, 5-TRANS-

Common Name

English

9,10-SECOCHOLESTA-5,7,10(19)-TRIENE-3,25-DIOL, (3.BETA.,5E,7E)-

Common Name

English

CALCIFEDIOL MONOHYDRATE IMPURITY D [EP IMPURITY]

Common Name

English

(3S,5E,7E)-9,10-secocholesta-5,7,10(19)-triene-3,25-diol

Systematic Name

English

5,6-TRANS-25-HYDROXY VITAMIN D3

Common Name

English

25-HYDROXY-5,6-TRANS-CHOLECALCIFEROL

Common Name

English

Code System Code Type Description

FDA UNII

SN331791VY