.BETA.-VETIVONE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H22O
Molecular Weight	218.3346
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-VETIVONE

Structure Search

SMILES

[H][C@@]1(C)CC(=O)C=C(C)[C@@]12CCC(C2)=C(C)C

InChI

InChIKey=ISLOGSAEQNKPGG-DOMZBBRYSA-N

InChI=1S/C15H22O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12H,5-6,8-9H2,1-4H3/t12-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H22O
Molecular Weight	218.3346
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:08:21 GMT 2023` Edited by `admin` on `Fri Dec 15 19:08:21 GMT 2023`
Record UNII	V86K3R7R4P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-VETIVONE

Common Name

English

2-ISOPROPYLIDENE-6,10-DIMETHYLSPIRO(4.5)DEC-6-EN-.BETA.-ONE

Common Name

English

(5R-CIS)-6,10-DIMETHYL-2-(1-METHYLETHYLIDENE)SPIRO(4.5)DEC-6-EN-.BETA.-ONE

Common Name

English

.BETA.-VETIVONE [MI]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID70885043

Created by admin on Fri Dec 15 19:08:21 GMT 2023 , Edited by admin on Fri Dec 15 19:08:21 GMT 2023

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MERCK INDEX

m11437

Created by admin on Fri Dec 15 19:08:21 GMT 2023 , Edited by admin on Fri Dec 15 19:08:21 GMT 2023

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Merck Index

PUBCHEM

442406

Created by admin on Fri Dec 15 19:08:21 GMT 2023 , Edited by admin on Fri Dec 15 19:08:21 GMT 2023

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FDA UNII

V86K3R7R4P

Created by admin on Fri Dec 15 19:08:21 GMT 2023 , Edited by admin on Fri Dec 15 19:08:21 GMT 2023

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CAS

18444-79-6

Created by admin on Fri Dec 15 19:08:21 GMT 2023 , Edited by admin on Fri Dec 15 19:08:21 GMT 2023

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