TETRAHYDROISOHUMULONE, CIS-

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H34O5
Molecular Weight	366.4917
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of TETRAHYDROISOHUMULONE, CIS-

Structure Search

SMILES

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

InChI

InChIKey=JIZQRWKUYFNSDM-VFNWGFHPSA-N

InChI=1S/C21H34O5/c1-12(2)7-9-15-19(24)18(16(22)11-14(5)6)20(25)21(15,26)17(23)10-8-13(3)4/h12-15,25-26H,7-11H2,1-6H3/t15-,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H34O5
Molecular Weight	366.4917
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 `Sat Dec 16 08:32:03 GMT 2023` Edited by `admin` on `Sat Dec 16 08:32:03 GMT 2023`
Record UNII	O5999N0H6U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TETRAHYDROISOHUMULONE, CIS-

Common Name

English

2-CYCLOPENTEN-1-ONE, 3,4-DIHYDROXY-5-(3-METHYLBUTYL)-2-(3-METHYL-1-OXOBUTYL)-4-(4-METHYL-1-OXOPENTYL)-, CIS-

Common Name

English

(±)-CIS-TETRAHYDROISOHUMULONE

Common Name

English

2-CYCLOPENTEN-1-ONE, 3,4-DIHYDROXY-5-(3-METHYLBUTYL)-2-(3-METHYL-1-OXOBUTYL)-4-(4-METHYL-1-OXOPENTYL)-, (4R,5S)-REL-

Systematic Name

English

TETRAHYDROISOHUMULONE, (±)-CIS-

Common Name

English

2-CYCLOPENTEN-1-ONE, 3,4-DIHYDROXY-5-(3-METHYLBUTYL)-2-(3-METHYL-1-OXOBUTYL)-4-(4-METHYL-1-OXOPENTYL)-, CIS-(±)-

Systematic Name

English

KDT-500, (±)-

Common Name

English

Code System Code Type Description

CAS

26054-19-3

Created by admin on Sat Dec 16 08:32:03 GMT 2023 , Edited by admin on Sat Dec 16 08:32:03 GMT 2023

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PUBCHEM

25015707

Created by admin on Sat Dec 16 08:32:03 GMT 2023 , Edited by admin on Sat Dec 16 08:32:03 GMT 2023

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FDA UNII

O5999N0H6U

Created by admin on Sat Dec 16 08:32:03 GMT 2023 , Edited by admin on Sat Dec 16 08:32:03 GMT 2023

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