ANTROSTEROL

Details

Stereochemistry	EPIMERIC
Molecular Formula	C28H44O
Molecular Weight	396.6484
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 8
E/Z Centers	1
Charge	0
Stereo Comments	Assumed E and 14R as in other similar substances

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(CC[C@@]2([H])C3=CCC4C[C@@H](O)CC[C@]4(C)C3=CC[C@]12C)[C@H](C)\C=C\[C@H](C)C(C)C

InChI

InChIKey=XSMGJKKUFBTARU-SMQIQWERSA-N

InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,14,18-22,24-25,29H,9,11-13,15-17H2,1-6H3/b8-7+/t19-,20+,21?,22-,24+,25-,27-,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H44O
Molecular Weight	396.6484
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	7 / 8
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:42:22 UTC 2023` Edited by `admin` on `Sat Dec 16 18:42:22 UTC 2023`
Record UNII	3SG8S75P9L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ANTROSTEROL

Common Name

English

ST1

Common Name

English

EK100

Code

English

ERGOSTA-7,9(11),22-TRIEN-3-OL, (3.BETA.,22E)-

Common Name

English

EK-100

Code

English

Code System Code Type Description

CAS

59202-60-7

Created by admin on Sat Dec 16 18:42:22 UTC 2023 , Edited by admin on Sat Dec 16 18:42:22 UTC 2023

PRIMARY

FDA UNII

3SG8S75P9L

Created by admin on Sat Dec 16 18:42:22 UTC 2023 , Edited by admin on Sat Dec 16 18:42:22 UTC 2023

PRIMARY

PUBCHEM

101027368

Created by admin on Sat Dec 16 18:42:22 UTC 2023 , Edited by admin on Sat Dec 16 18:42:22 UTC 2023

PRIMARY

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