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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H48O6
Molecular Weight 480.6771
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ECRAPROST

SMILES

CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(OC(=O)CCC)=C1CCCCCCC(=O)OCCCC

InChI

InChIKey=HITYEEHTEOQBAC-OSIGYOHNSA-N
InChI=1S/C28H48O6/c1-4-7-11-15-22(29)18-19-23-24(26(21-25(23)30)34-28(32)14-6-3)16-12-9-10-13-17-27(31)33-20-8-5-2/h18-19,22-23,25,29-30H,4-17,20-21H2,1-3H3/b19-18+/t22-,23+,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H48O6
Molecular Weight 480.6771
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:19:46 UTC 2023
Edited
by admin
on Sat Dec 16 16:19:46 UTC 2023
Record UNII
Q2XM6VR8DO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ECRAPROST
INN   USAN  
INN   USAN  
Official Name English
CIRCULASE
Brand Name English
ECRAPROST [USAN]
Common Name English
Butyl (4R,5R)-2,4-dihydroxy-5-[(1E,3S)-3-hydroxy-1-octenyl]-1-cyclopentene-1-heptanoate, 2-butyrate
Common Name English
ecraprost [INN]
Common Name English
PROSTA-8,13-DIEN-1-OIC ACID, 11,15-DIHYDROXY-9-(1-OXOBUTOXY)-, BUTYL ESTER, (11.ALPHA.,13E,15S)-
Common Name English
AS-013
Code English
Classification Tree Code System Code
NCI_THESAURUS C1327
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
FDA ORPHAN DRUG 112898
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
Code System Code Type Description
ChEMBL
CHEMBL2104574
Created by admin on Sat Dec 16 16:19:46 UTC 2023 , Edited by admin on Sat Dec 16 16:19:46 UTC 2023
PRIMARY
CAS
136892-64-3
Created by admin on Sat Dec 16 16:19:46 UTC 2023 , Edited by admin on Sat Dec 16 16:19:46 UTC 2023
PRIMARY
SMS_ID
300000034171
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
PRIMARY
INN
7999
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
PRIMARY
PUBCHEM
6917049
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
PRIMARY
FDA UNII
Q2XM6VR8DO
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
PRIMARY
USAN
LL-64
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
PRIMARY
NCI_THESAURUS
C76397
Created by admin on Sat Dec 16 16:19:47 UTC 2023 , Edited by admin on Sat Dec 16 16:19:47 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE ACTIVE -> PRODRUG
Related Record Type Details
ACTIVE MOIETY