PREVITAMIN D2

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H44O
Molecular Weight	396.6484
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=XQFJZHAVTPYDIQ-BIADAZNZSA-N

InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h8-10,12-13,19-20,22,25-27,29H,7,11,14-18H2,1-6H3/b10-9+,13-12-/t20-,22+,25-,26+,27-,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H44O
Molecular Weight	396.6484
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 `Mon Mar 31 22:01:13 GMT 2025` Edited by `admin` on `Mon Mar 31 22:01:13 GMT 2025`
Record UNII	J3JFD8W6Y5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PREERGOCALCIFEROL

Preferred Name

English

PREVITAMIN D2

Common Name

English

(1S)-3-((1Z)-2-((1R,3AR,7AR)-2,3,3A,6,7,7A-HEXAHYDRO-7A-METHYL-1-((1R,2E,4R)-1,4,5-TRIMETHYL-2-HEXENYL)-1H-INDEN-4-YL)ETHENYL)-4-METHYL-3-CYCLOHEXEN-1-OL

Systematic Name

English

3-CYCLOHEXEN-1-OL, 3-((1Z)-2-((1R,3AR,7AR)-2,3,3A,6,7,7A-HEXAHYDRO-7A-METHYL-1-((1R,2E,4R)-1,4,5-TRIMETHYL-2-HEXENYL)-1H-INDEN-4-YL)ETHENYL)-4-METHYL-, (1S)-

Systematic Name

English

PROVITAMIN-D2

Common Name

English

9,10-SECOERGOSTA-5(10),6,8,22-TETRAEN-3-OL, (3.BETA.,6Z,22E)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9547229

Created by admin on Mon Mar 31 22:01:13 GMT 2025 , Edited by admin on Mon Mar 31 22:01:13 GMT 2025

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CAS

21307-05-1

Created by admin on Mon Mar 31 22:01:13 GMT 2025 , Edited by admin on Mon Mar 31 22:01:13 GMT 2025

PRIMARY

FDA UNII

J3JFD8W6Y5

Created by admin on Mon Mar 31 22:01:13 GMT 2025 , Edited by admin on Mon Mar 31 22:01:13 GMT 2025

PRIMARY