6,8-DIHYDROXY-4,8-DIMETHYL-11-ISOPROPYL-14-OXO-4,9-PENTADECADIENOIC ACID, (4E,6R,8S,9E,11S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H34O5
Molecular Weight	354.481
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 6,8-DIHYDROXY-4,8-DIMETHYL-11-ISOPROPYL-14-OXO-4,9-PENTADECADIENOIC ACID, (4E,6R,8S,9E,11S)-

Structure Search

SMILES

CC(C)[C@H](CCC(C)=O)\C=C\[C@@](C)(O)C[C@@H](O)\C=C(/C)CCC(O)=O

InChI

InChIKey=UUPXPGYKZYACRW-CIOCWZRSSA-N

InChI=1S/C20H34O5/c1-14(2)17(8-7-16(4)21)10-11-20(5,25)13-18(22)12-15(3)6-9-19(23)24/h10-12,14,17-18,22,25H,6-9,13H2,1-5H3,(H,23,24)/b11-10+,15-12+/t17-,18+,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H34O5
Molecular Weight	354.481
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:13:48 GMT 2023` Edited by `admin` on `Sat Dec 16 15:13:48 GMT 2023`
Record UNII	DOE075Q0Q7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6,8-DIHYDROXY-4,8-DIMETHYL-11-ISOPROPYL-14-OXO-4,9-PENTADECADIENOIC ACID, (4E,6R,8S,9E,11S)-

Systematic Name

English

4,9-PENTADECADIENOIC ACID, 6,8-DIHYDROXY-4,8-DIMETHYL-11-(1-METHYLETHYL)-14-OXO-, (6R-(4E,6R*,8S*,9E,11S*))-

Systematic Name

English

Code System Code Type Description

FDA UNII

DOE075Q0Q7

Created by admin on Sat Dec 16 15:13:48 GMT 2023 , Edited by admin on Sat Dec 16 15:13:48 GMT 2023

PRIMARY

PUBCHEM

135390754

Created by admin on Sat Dec 16 15:13:48 GMT 2023 , Edited by admin on Sat Dec 16 15:13:48 GMT 2023

PRIMARY

CAS

102734-47-4

Created by admin on Sat Dec 16 15:13:48 GMT 2023 , Edited by admin on Sat Dec 16 15:13:48 GMT 2023

PRIMARY

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6,8-DIHYDROXY-4,8-DIMETHYL-11-ISOPROPYL-14-OXO-4,9-PENTADECADIENOIC ACID, (4E,6R,8RS,9E,11S)-

EPIMER -> DIASTEREOISOMER