VITAMIN D5

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H48O
Molecular Weight	412.6908
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	2
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)CCC3=C)[C@H](C)CC[C@@H](CC)C(C)C

InChI

InChIKey=RMDJVOZETBHEAR-LQYWTLTGSA-N

InChI=1S/C29H48O/c1-7-23(20(2)3)12-10-22(5)27-16-17-28-24(9-8-18-29(27,28)6)13-14-25-19-26(30)15-11-21(25)4/h13-14,20,22-23,26-28,30H,4,7-12,15-19H2,1-3,5-6H3/b24-13+,25-14-/t22-,23-,26+,27-,28+,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H48O
Molecular Weight	412.6908
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:50:24 GMT 2023` Edited by `admin` on `Fri Dec 15 19:50:24 GMT 2023`
Record UNII	0W2I161LCL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VITAMIN D5

Common Name

English

9,10-SECOSTIGMASTA-5,7,10(19)-TRIEN-3-OL, (3.BETA.,5Z,7E)-

Common Name

English

CYCLOHEXANOL, 5-((2E)-2-((1R,3AS,7AR)-1-((1R,4R)-4-ETHYL-1,5-DIMETHYLHEXYL)OCTAHYDRO-7A-METHYL-4H-INDEN-4-YLIDENE)ETHYLIDENE)-4-METHYLENE-, (1S,5Z)-

Systematic Name

English

SITOCALCIFEROL

Common Name

English

24R-METHYLCALCIOL

Common Name

English

Sitocalciferol [WHO-DD]

Common Name

English

Code System Code Type Description

WIKIPEDIA

VITAMIN D5