24,25-DIHYDROXYCHOLECALCIFEROL

Details

Stereochemistry	EPIMERIC
Molecular Formula	C27H44O3
Molecular Weight	416.6365
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 24,25-DIHYDROXYCHOLECALCIFEROL

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)CCC(O)C(C)(C)O

InChI

InChIKey=FCKJYANJHNLEEP-SRLFHJKTSA-N

InChI=1S/C27H44O3/c1-18-8-12-22(28)17-21(18)11-10-20-7-6-16-27(5)23(13-14-24(20)27)19(2)9-15-25(29)26(3,4)30/h10-11,19,22-25,28-30H,1,6-9,12-17H2,2-5H3/b20-10+,21-11-/t19-,22+,23-,24+,25?,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H44O3
Molecular Weight	416.6365
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:23:04 UTC 2023` Edited by `admin` on `Sat Dec 16 05:23:04 UTC 2023`
Record UNII	0AXX2V8L5Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

24,25-DIHYDROXYCHOLECALCIFEROL

Common Name

English

24,25-DIHYDROXYVITAMIN D 3

Common Name

English

2,3-HEPTANEDIOL, 2-METHYL-6-((1R,3AS,4E,7AR)-OCTAHYDRO-4-((2Z)-2-((5S)-5-HYDROXY-2-METHYLENECYCLOHEXYLIDENE)ETHYLIDENE)-7A-METHYL-1H-INDEN-1-YL)-, (6R)-

Common Name

English

24,25-DIHYDROXYVITAMIN D3

Common Name

English

SECALCIFEROL, (24RS)-

Common Name

English

24-HYDROXYCALCIDIOL

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C941