OROBANCHOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H22O6
Molecular Weight	346.3744
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12OC(=O)\C(=C\O[C@@H]3OC(=O)C(C)=C3)[C@]1([H])[C@@H](O)C4=C2C(C)(C)CCC4

InChI

InChIKey=CDBBMEYPRMUMTR-KIKJJFSISA-N

InChI=1S/C19H22O6/c1-9-7-12(24-17(9)21)23-8-11-13-15(20)10-5-4-6-19(2,3)14(10)16(13)25-18(11)22/h7-8,12-13,15-16,20H,4-6H2,1-3H3/b11-8+/t12-,13-,15+,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H22O6
Molecular Weight	346.3744
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:26:47 GMT 2023` Edited by `admin` on `Sat Dec 16 16:26:47 GMT 2023`
Record UNII	HT1825LV39
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OROBANCHOL

Common Name

English

OROBANCHOL [MI]

Common Name

English

(+)-OROBANCHOL

Common Name

English

2H-INDENO(1,2-B)FURAN-2-ONE, 3-((((2R)-2,5-DIHYDRO-4-METHYL-5-OXO-2-FURANYL)OXY)METHYLENE)-3,3A,4,5,6,7,8,8B-OCTAHYDRO-4-HYDROXY-8,8-DIMETHYL-, (3E,3AR,4R,8BR)-

Systematic Name

English

(3E,3AR,4R,8BR)-3-((((2R)-2,5-DIHYDRO-4-METHYL-5-OXO-2-FURANYL)OXY)METHYLENE)-3,3A,4,5,6,7,8,8B-OCTAHYDRO-4-HYDROXY-8,8-DIMETHYL-2H-INDENO(1,2-B)FURAN-2-ONE

Systematic Name

English

Code System Code Type Description

CAS

220493-65-2

Created by admin on Sat Dec 16 16:26:47 GMT 2023 , Edited by admin on Sat Dec 16 16:26:47 GMT 2023

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PUBCHEM

54754036

Created by admin on Sat Dec 16 16:26:47 GMT 2023 , Edited by admin on Sat Dec 16 16:26:47 GMT 2023

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FDA UNII

HT1825LV39

Created by admin on Sat Dec 16 16:26:47 GMT 2023 , Edited by admin on Sat Dec 16 16:26:47 GMT 2023

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MERCK INDEX

m12006

Created by admin on Sat Dec 16 16:26:47 GMT 2023 , Edited by admin on Sat Dec 16 16:26:47 GMT 2023

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