ESTRADIOL SULFAMATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H25NO4S
Molecular Weight	351.46
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(OS(N)(=O)=O)=CC=C34)[C@@H]1CC[C@@H]2O

InChI

InChIKey=YXYXCSOJKUAPJI-ZBRFXRBCSA-N

InChI=1S/C18H25NO4S/c1-18-9-8-14-13-5-3-12(23-24(19,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,20H,2,4,6-9H2,1H3,(H2,19,21,22)/t14-,15-,16+,17+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H25NO4S
Molecular Weight	351.46
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 00:55:36 GMT 2025` Edited by `admin` on `Wed Apr 02 00:55:36 GMT 2025`
Record UNII	WO55ODW08Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

E2MATE

Preferred Name

English

ESTRADIOL SULFAMATE

Common Name

English

ESTRA-1,3,5(10)-TRIENE-3,17-DIOL (17.BETA.)-, 3-SULFAMATE

Common Name

English

ZK190628

Code

English

ZK-190628

Code

English

J-995

Code

English

ESTRADIOL 3-SULFAMATE

Common Name

English

PGL-2001

Code

English

PGL2001

Code

English

J995

Code

English

BLE-00084

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID801337121