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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H32O6
Molecular Weight 476.5608
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESTRIOL DIACETATE BENZOATE

SMILES

[H][C@@]12C[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@]1(C)CC[C@]3([H])C4=C(CC[C@@]23[H])C=C(OC(=O)C5=CC=CC=C5)C=C4

InChI

InChIKey=VQHGRIUWSVCJPX-HSZAMCLRSA-N
InChI=1S/C29H32O6/c1-17(30)33-26-16-25-24-11-9-20-15-21(35-28(32)19-7-5-4-6-8-19)10-12-22(20)23(24)13-14-29(25,3)27(26)34-18(2)31/h4-8,10,12,15,23-27H,9,11,13-14,16H2,1-3H3/t23-,24-,25+,26-,27+,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula C29H32O6
Molecular Weight 476.5608
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Description
Curator's Comment: Description was created based on several sources, including http://www.genome.jp/dbget-bin/www_bget?dr:D01989

Estriol acetate benzoate is a semisynthetic, steroidal estrogen. Estriol benzoate diacetate is reported as an ingredient of Holin in Japan. It is an estrogen receptor agonist.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Holin

Approved Use

Menopausal hormone replacement therapy
PubMed

PubMed

TitleDatePubMed

Sample Use Guides

In Vivo Use Guide
Curator's Comment: Oral or vaginal
Oral Menopausal HRT Adult: 0.5-3 mg daily for 1 mth followed by 0.5-1 mg daily; or 0.25-2 mg daily in combination with other natural oestrogens. A progestogen is required if administered to women with a uterus. Oral Infertility due to cervical hostility Adult: 0.25-1 mg/day on days 6-15 of the menstrual cycle. Increase dose each mth until an optimal effect is obtained. Oral Atrophy of the lower urogenital tract related to estrogen deficiency Adult: 4-8 mg/day for the 1 st wk then taper down to 1-2 mg/day. Vaginal Menopausal atrophic vaginitis Adult: As 0.01% or 0.1% cream or 500 mcg pessary: Apply 500 mcg once daily, reduce to twice wkly subsequently.
Route of Administration: Oral
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 06:19:13 GMT 2023
Edited
by admin
on Sat Dec 16 06:19:13 GMT 2023
Record UNII
64EY62BBUA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESTRIOL DIACETATE BENZOATE
JAN   WHO-DD  
Common Name English
ESTRIOL 3-BENZOATE 16,17-DIACETATE
Common Name English
ESTRA-1,3,5(10)-TRIENE-3,16,17-TRIOL, 16,17-DIACETATE 3-BENZOATE
Common Name English
ESTRIOL BENZOATE DIACETATE
Common Name English
3-BENZOYLOXY-16.ALPHA.,17.BETA.-DIACETOXY-ESTRANE-1,3,5(10)-TRIENE
Systematic Name English
ESTRIOL DIACETATE BENZOATE [JAN]
Common Name English
ESTRIOL, 16,17-DIACETATE BENZOATE
Common Name English
ESTRIOL ACETATE BENZOATE
Common Name English
Estriol diacetate benzoate [WHO-DD]
Common Name English
ESTRIOL, 16,17-DIACETATE 3-BENZOATE
Common Name English
Code System Code Type Description
WIKIPEDIA
Estriol acetate benzoate
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
PRIMARY
PUBCHEM
656637
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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EVMPD
SUB77781
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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CAS
2508-47-6
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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FDA UNII
64EY62BBUA
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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ChEMBL
CHEMBL193482
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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EPA CompTox
DTXSID8057697
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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SMS_ID
100000138324
Created by admin on Sat Dec 16 06:19:13 GMT 2023 , Edited by admin on Sat Dec 16 06:19:13 GMT 2023
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