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Details

Stereochemistry EPIMERIC
Molecular Formula C20H34O5
Molecular Weight 354.481
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 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,8RS,9E,11S)-

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-BMSOJYPXSA-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 EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:43:49 GMT 2023
Edited
by admin
on Sat Dec 16 14:43:49 GMT 2023
Record UNII
9RPT68P0ZK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6,8-DIHYDROXY-4,8-DIMETHYL-11-ISOPROPYL-14-OXO-4,9-PENTADECADIENOIC ACID, (4E,6R,8RS,9E,11S)-
Systematic Name English
4,9-PENTADECADIENOIC ACID, 6,8-DIHYDROXY-4,8-DIMETHYL-11-(1-METHYLETHYL)-14-OXO-
Systematic Name English
Code System Code Type Description
PUBCHEM
137552090
Created by admin on Sat Dec 16 14:43:49 GMT 2023 , Edited by admin on Sat Dec 16 14:43:49 GMT 2023
PRIMARY
CAS
70898-33-8
Created by admin on Sat Dec 16 14:43:49 GMT 2023 , Edited by admin on Sat Dec 16 14:43:49 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
9RPT68P0ZK
Created by admin on Sat Dec 16 14:43:49 GMT 2023 , Edited by admin on Sat Dec 16 14:43:49 GMT 2023
PRIMARY