ISOTACHYSTEROL 3

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H44O
Molecular Weight	384.6377
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CCC[C@@H](C)[C@H]1CCC2=C(CCC[C@]12C)\C=C\C3=C(C)CC[C@H](O)C3

InChI

InChIKey=ZPZNWLRQHDLNNV-QVEMQNNUSA-N

InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-25,28H,6-11,14-18H2,1-5H3/b13-12+/t21-,24+,25-,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H44O
Molecular Weight	384.6377
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:13:54 GMT 2025` Edited by `admin` on `Mon Mar 31 23:13:54 GMT 2025`
Record UNII	I627F2EB69
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOTACHYSTEROL 3

Common Name

English

ISOTACHYSTEROL3

Preferred Name

English

9,10-SECOCHOLESTA-5(10),6,8(14)-TRIEN-3.BETA.-OL, (E)-

Systematic Name

English

CHOLECALCIFEROL IMPURITY D (EP)

Common Name

English

9,10-SECOCHOLESTA-5(10),6,8(14)-TRIEN-3-OL, (3.BETA.,6E)-

Systematic Name

English

(6E)-9,10-SECOCHOLESTA-5(10),6,8(14)-TRIEN-3.BETA.-OL

Systematic Name

English

TOXISTEROL3 D3

Common Name

English

Code System Code Type Description

DAILYMED

I627F2EB69