12,13-EPOXYTRICHOTHEC-9-ENE, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H22O2
Molecular Weight	234.334
Optical Activity	( + / - )
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 12,13-EPOXYTRICHOTHEC-9-ENE, (±)-

Structure Search

SMILES

[H][C@]12O[C@@H]3CC[C@@](C)([C@]34CO4)[C@@]1(C)CCC(C)=C2

InChI

InChIKey=LZAJKCZTKKKZNT-QMIVOQANSA-N

InChI=1S/C15H22O2/c1-10-4-6-13(2)12(8-10)17-11-5-7-14(13,3)15(11)9-16-15/h8,11-12H,4-7,9H2,1-3H3/t11-,12-,13+,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C15H22O2
Molecular Weight	234.334
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:54:46 GMT 2023` Edited by `admin` on `Sat Dec 16 01:54:46 GMT 2023`
Record UNII	QIQ1F6SUZ5
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

12,13-EPOXYTRICHOTHEC-9-ENE, (±)-

Common Name

English

(±)-SCIRPENE

Common Name

English

TRICHOTHEC-9-ENE, 12,13-EPOXY-, (±)-

Common Name

English

(±)-12,13-EPOXYTRICHOTHEC-9-ENE

Common Name

English

SPIRO(2,5-METHANO-1-BENZOXEPIN-10,2'-OXIRANE), 2,3,4,5,5A,6,7,9A-OCTAHYDRO-5,5A,8-TRIMETHYL-, (2R,2'S,5R,5AR,9AR)-REL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

162245

Created by admin on Sat Dec 16 01:54:46 GMT 2023 , Edited by admin on Sat Dec 16 01:54:46 GMT 2023

PRIMARY

FDA UNII

QIQ1F6SUZ5

Created by admin on Sat Dec 16 01:54:46 GMT 2023 , Edited by admin on Sat Dec 16 01:54:46 GMT 2023

PRIMARY

CAS

54713-65-4

Created by admin on Sat Dec 16 01:54:46 GMT 2023 , Edited by admin on Sat Dec 16 01:54:46 GMT 2023

PRIMARY

Related Record Type Details


					2VT926P95A

12,13-EPOXYTRICHOTHEC-9-ENE

ENANTIOMER -> RACEMATE