.ALPHA.-AMYRENONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H48O
Molecular Weight	424.7015
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C

InChI

InChIKey=DIFWJJFSELKWGA-IPQOMUISSA-N

InChI=1S/C30H48O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-23,25H,10-18H2,1-8H3/t19-,20+,22+,23-,25+,27-,28+,29-,30-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H48O
Molecular Weight	424.7015
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:21:27 GMT 2025` Edited by `admin` on `Mon Mar 31 20:21:27 GMT 2025`
Record UNII	XLL7MH4OJO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-AMYRENONE

Common Name

English

.ALPHA.-AMIRENONE

Preferred Name

English

.ALPHA.-AMYRONE

Common Name

English

URS-12-EN-3-ONE

Common Name

English

.ALPHA.-AMIRONE

Common Name

English

3-KETOURS-12-ENE

Common Name

English

3-OXOURS-12-ENE

Common Name

English

Code System Code Type Description

FDA UNII

XLL7MH4OJO

Created by admin on Mon Mar 31 20:21:27 GMT 2025 , Edited by admin on Mon Mar 31 20:21:27 GMT 2025

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EPA CompTox

DTXSID10980369

Created by admin on Mon Mar 31 20:21:27 GMT 2025 , Edited by admin on Mon Mar 31 20:21:27 GMT 2025

PRIMARY

CAS

638-96-0

Created by admin on Mon Mar 31 20:21:27 GMT 2025 , Edited by admin on Mon Mar 31 20:21:27 GMT 2025

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PUBCHEM

12306155

Created by admin on Mon Mar 31 20:21:27 GMT 2025 , Edited by admin on Mon Mar 31 20:21:27 GMT 2025

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