ESTRADIOL HEMIHYDRATE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	2C18H24O2.H2O
Molecular Weight	562.7792
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ESTRADIOL HEMIHYDRATE

Structure Search

SMILES

O.[H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]3([H])C4=C(CC[C@@]23[H])C=C(O)C=C4.[H][C@@]56CC[C@H](O)[C@@]5(C)CC[C@]7([H])C8=C(CC[C@@]67[H])C=C(O)C=C8

InChI

InChIKey=ZVVGLAMWAQMPDR-WVEWYJOQSA-N

InChI=1S/2C18H24O2.H2O/c2*1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20;/h2*3,5,10,14-17,19-20H,2,4,6-9H2,1H3;1H2/t2*14-,15-,16+,17+,18+;/m11./s1

HIDE SMILES / InChI

Molecular Formula	C18H24O2
Molecular Weight	272.382
Charge	0
Count

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

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:57:12 UTC 2023` Edited by `admin` on `Fri Dec 15 15:57:12 UTC 2023`
Record UNII	CXY7B3Q98Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ESTRADIOL HEMIHYDRATE

Common Name

English

Estradiol hemihydrate [WHO-DD]

Common Name

English

ESTRADIOL HEMIHYDRATE [MI]

Common Name

English

ESTRASORB

Brand Name

English

MYFEMBREE COMPONENT ESTRADIOL HEMIHYDRATE

Brand Name

English

ESTRADIOL HEMIHYDRATE [ORANGE BOOK]

Common Name

English

ESTRADIOL HEMIHYDRATE [EP MONOGRAPH]

Common Name

English

ESTRADIOL HEMIHYDRATE COMPONENT OF MYFEMBREE

Brand Name

English

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

Common Name

English

Classification Tree Code System Code

EMA ASSESSMENT REPORTS

ZOELY (AUTHORIZED: CONTRACEPTION)

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

EU-Orphan Drug

EU/3/05/275

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

NCI_THESAURUS

C478

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

Code System Code Type Description

DRUG BANK

DBSALT001383

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

RXCUI

236859

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

RxNorm

SMS_ID

100000089218

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

PUBCHEM

154274

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

EPA CompTox

DTXSID60858948

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

FDA UNII

CXY7B3Q98Z

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

WIKIPEDIA

Estradiol hemihydrate

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

ChEMBL

CHEMBL135

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

NCI_THESAURUS

C47992

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

MERCK INDEX

m5028

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

Merck Index

DAILYMED

CXY7B3Q98Z

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

EVMPD

SUB11941MIG

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

CAS

35380-71-3

Created by admin on Fri Dec 15 15:57:13 UTC 2023 , Edited by admin on Fri Dec 15 15:57:13 UTC 2023

PRIMARY

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