AMBROSIN, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H18O3
Molecular Weight	246.3016
Optical Activity	( + / - )
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@H](C)[C@]3([H])C=CC(=O)[C@@]3(C)[C@]1([H])OC(=O)C2=C

InChI

InChIKey=IFXGCKRDLITNAU-JHSUYXJUSA-N

InChI=1S/C15H18O3/c1-8-4-5-10-9(2)14(17)18-13(10)15(3)11(8)6-7-12(15)16/h6-8,10-11,13H,2,4-5H2,1,3H3/t8-,10-,11-,13+,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H18O3
Molecular Weight	246.3016
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:00:26 GMT 2023` Edited by `admin` on `Sat Dec 16 09:00:26 GMT 2023`
Record UNII	QE9HO4LN0U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AMBROSIN, (±)-

Common Name

English

AZULENO(4,5-B)FURAN-2,9-DIONE, 3,3A,4,5,6,6A,9A,9B-OCTAHYDRO-6,9A-DIMETHYL-3-METHYLENE-, (3AS,6S,6AR,9AR,9BR)-REL-

Systematic Name

English

AMBROSIN (±)-FORM [MI]

Common Name

English

(±)-AMBROSIN

Common Name

English

Code System Code Type Description

FDA UNII

QE9HO4LN0U

Created by admin on Sat Dec 16 09:00:26 GMT 2023 , Edited by admin on Sat Dec 16 09:00:26 GMT 2023

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PUBCHEM

92119

Created by admin on Sat Dec 16 09:00:26 GMT 2023 , Edited by admin on Sat Dec 16 09:00:26 GMT 2023

PRIMARY

CAS

64813-79-2

Created by admin on Sat Dec 16 09:00:26 GMT 2023 , Edited by admin on Sat Dec 16 09:00:26 GMT 2023

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MERCK INDEX

m1649

Created by admin on Sat Dec 16 09:00:26 GMT 2023 , Edited by admin on Sat Dec 16 09:00:26 GMT 2023

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Merck Index