.BETA.-SANTALYL PHENYLACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H30O2
Molecular Weight	338.4831
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-SANTALYL PHENYLACETATE

Structure Search

SMILES

C\C(COC(=O)CC1=CC=CC=C1)=C\CC[C@]2(C)[C@H]3CC[C@H](C3)C2=C

InChI

InChIKey=FIZFZQIBGCHOJY-XYAFSINWSA-N

InChI=1S/C23H30O2/c1-17(16-25-22(24)14-19-9-5-4-6-10-19)8-7-13-23(3)18(2)20-11-12-21(23)15-20/h4-6,8-10,20-21H,2,7,11-16H2,1,3H3/b17-8-/t20-,21+,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H30O2
Molecular Weight	338.4831
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:46:49 GMT 2025` Edited by `admin` on `Mon Mar 31 20:46:49 GMT 2025`
Record UNII	E4IO2F954N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-SANTALYL PHENYLACETATE

Common Name

English

FEMA NO. 3008, .BETA.-

Preferred Name

English

BENZENEACETIC ACID, (2Z)-2-METHYL-5-((1S,2R,4R)-2-METHYL-3-METHYLENEBICYCLO(2.2.1)HEPT-2-YL)-2-PENTEN-1-YL ESTER

Common Name

English

ACETIC ACID, PHENYL-, ESTER WITH .BETA.-SANTALOL

Common Name

English

BENZENEACETIC ACID, (2Z)-2-METHYL-5-((1S,2R,4R)-2-METHYL-3-METHYLENEBICYCLO(2.2.1)HEPT-2-YL)-2-PENTENYL ESTER

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID30179394

Created by admin on Mon Mar 31 20:46:49 GMT 2025 , Edited by admin on Mon Mar 31 20:46:49 GMT 2025

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PUBCHEM

71587670

Created by admin on Mon Mar 31 20:46:49 GMT 2025 , Edited by admin on Mon Mar 31 20:46:49 GMT 2025

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CAS

246507-14-2

Created by admin on Mon Mar 31 20:46:49 GMT 2025 , Edited by admin on Mon Mar 31 20:46:49 GMT 2025

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FDA UNII

E4IO2F954N

Created by admin on Mon Mar 31 20:46:49 GMT 2025 , Edited by admin on Mon Mar 31 20:46:49 GMT 2025

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