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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H21O5S.Na
Molecular Weight 372.411
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESTRONE SODIUM SULFATE

SMILES

[Na+].[H][C@@]12CCC(=O)[C@@]1(C)CC[C@]3([H])C4=C(CC[C@@]23[H])C=C(OS([O-])(=O)=O)C=C4

InChI

InChIKey=VUCAHVBMSFIGAI-ZFINNJDLSA-M
InChI=1S/C18H22O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22);/q;+1/p-1/t14-,15-,16+,18+;/m1./s1

HIDE SMILES / InChI

Approval Year

Unknown
86413
Name Type Language
ESTRONE SODIUM SULFATE
VANDF   WHO-DD  
Common Name English
ESTRONE SODIUM SULFATE [VANDF]
Common Name English
SODIUM 17-OXOESTRA-1,3,5(10)-TRIEN-3-YL SULFATE
Systematic Name English
SODIUM (8R,9S,13S,14S)-13-METHYL-17-OXO-7,8,9,11,12,13,14,15,16,17-DECAHYDRO-6H-CYCLOPENTA(A)PHENANTHREN-3-YL SULFATE
Common Name English
SODIUM ESTRONE SULFATE
Common Name English
SODIUM ESTRONE SULPHATE
Common Name English
17-OXOESTRA-1,3,5(10)-TRIEN-3-YL SODIUM SULFATE
Systematic Name English
ESTRA-1,3,5(10)-TRIEN-17-ONE, 3-(SULFOOXY)-, SODIUM SALT
Common Name English
Estrone sodium sulfate [WHO-DD]
Common Name English
ESTRONE SODIUM SULPHATE
Common Name English
NSC-18313
Code English
Classification Tree Code System Code
NCI_THESAURUS C2181
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
Code System Code Type Description
NSC
18313
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
FDA UNII
6K6FDA543A
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
CAS
438-67-5
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
PUBCHEM
23667301
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
DRUG BANK
DB00286
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
NCI_THESAURUS
C61942
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
DAILYMED
6K6FDA543A
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
CHEBI
8389
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
EVMPD
SUB01976MIG
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
EPA CompTox
DTXSID00860005
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
MESH
C017296
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
ECHA (EC/EINECS)
207-120-4
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
SMS_ID
100000092374
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY
RXCUI
91428
Created by admin on Fri Dec 15 16:35:36 UTC 2023 , Edited by admin on Fri Dec 15 16:35:36 UTC 2023
PRIMARY RxNorm
ACTIVE MOIETY
Structure of ESTRONE
PARENT (SALT/SOLVATE)
Structure of ESTRONE SULFATE
NIH
NCATS
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