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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H34O6
Molecular Weight 370.4804
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of THROMBOXANE B2

SMILES

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

InChI

InChIKey=FMNQRUKVXAQEAZ-JNRFBPFXSA-N
InChI=1S/C20H34O6/c1-2-3-6-9-16(22)12-13-18(23)17(19(24)14-15-21)10-7-4-5-8-11-20(25)26/h4,7,12-13,15-19,22-24H,2-3,5-6,8-11,14H2,1H3,(H,25,26)/b7-4-,13-12+/t16-,17+,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H34O6
Molecular Weight 370.4804
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:47:24 UTC 2023
Edited
by admin
on Sat Dec 16 08:47:24 UTC 2023
Record UNII
V94M3R26ZV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THROMBOXANE B2
MI  
Common Name English
THROMBOXANE B2 [MI]
Common Name English
TXB2
Common Name English
5-HEPTENOIC ACID, 7-((2R,3S,4S)-TETRAHYDRO-4,6-DIHYDROXY-2-((1E,3S)-3-HYDROXY-1-OCTEN-1-YL)-2H-PYRAN-3-YL)-, (5Z)-
Systematic Name English
(5Z,9.ALPHA.,13E,15S)-9,11,15-TRIHYDROXYTHROMBOXA-5,13-DIEN-1-OIC ACID
Systematic Name English
PHD
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C879
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
Code System Code Type Description
WIKIPEDIA
Thromboxane B2
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
PUBCHEM
76956381
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
NCI_THESAURUS
C107560
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
FDA UNII
V94M3R26ZV
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
CHEBI
28728
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
MERCK INDEX
m10812
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY Merck Index
CHEBI
90696
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID60903947
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
CAS
54397-85-2
Created by admin on Sat Dec 16 08:47:24 UTC 2023 , Edited by admin on Sat Dec 16 08:47:24 UTC 2023
PRIMARY
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