3.BETA.-D-GLUCOPYRANOSYLVITAMIN D3

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C33H54O6
Molecular Weight	546.7783
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 3.BETA.-D-GLUCOPYRANOSYLVITAMIN D3

Structure Search

SMILES

[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C=C3\C[C@H](CCC3=C)O[C@]4([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](C)CCCC(C)C

InChI

InChIKey=TZHZRFDYMGRNII-OTNJCUTNSA-N

InChI=1S/C33H54O6/c1-20(2)8-6-9-22(4)26-15-16-27-23(10-7-17-33(26,27)5)12-13-24-18-25(14-11-21(24)3)38-32-31(37)30(36)29(35)28(19-34)39-32/h12-13,20,22,25-32,34-37H,3,6-11,14-19H2,1-2,4-5H3/b23-12+,24-13-/t22-,25+,26-,27+,28-,29-,30+,31-,32-,33-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C33H54O6
Molecular Weight	546.7783
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:16:20 GMT 2023` Edited by `admin` on `Fri Dec 15 15:16:20 GMT 2023`
Record UNII	Z44D5F3KC3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3.BETA.-D-GLUCOPYRANOSYLVITAMIN D3

Common Name

English

O-(.BETA.-D-GLUCOPYRANOSYL)CHOLECALCIFEROL

Common Name

English

VITAMIN D3 GLUCOSIDE

Common Name

English

.BETA.-D-GLUCOPYRANOSIDE, (1S,3Z)-3-((2E)-2-((1R,3AS,7AR)-1-((1R)-1,5-DIMETHYLHEXYL)OCTAHYDRO-7A-METHYL-4H-INDEN-4-YLIDENE)ETHYLIDENE)-4-METHYLENECYCLOHEXYL

Systematic Name

English

Code System Code Type Description

FDA UNII

Z44D5F3KC3

Created by admin on Fri Dec 15 15:16:20 GMT 2023 , Edited by admin on Fri Dec 15 15:16:20 GMT 2023

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PUBCHEM

21764976

Created by admin on Fri Dec 15 15:16:20 GMT 2023 , Edited by admin on Fri Dec 15 15:16:20 GMT 2023

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CAS

88508-78-5

Created by admin on Fri Dec 15 15:16:20 GMT 2023 , Edited by admin on Fri Dec 15 15:16:20 GMT 2023

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