ESTRADIOL DECANOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H42O3
Molecular Weight	426.6313
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@H](OC(=O)CCCCCCCCC)[C@@]1(C)CC[C@]3([H])C4=CC=C(O)C=C4CC[C@@]23[H]

InChI

InChIKey=YYFQNZXJGOTFRX-VMBLQBCYSA-N

InChI=1S/C28H42O3/c1-3-4-5-6-7-8-9-10-27(30)31-26-16-15-25-24-13-11-20-19-21(29)12-14-22(20)23(24)17-18-28(25,26)2/h12,14,19,23-26,29H,3-11,13,15-18H2,1-2H3/t23-,24-,25+,26+,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H42O3
Molecular Weight	426.6313
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 `Sat Dec 16 17:01:55 GMT 2023` Edited by `admin` on `Sat Dec 16 17:01:55 GMT 2023`
Record UNII	S4J8Z2L5LZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ESTRADIOL DECANOATE

Common Name

English

[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]decanoate

Systematic Name

English

(17β)-3-Hydroxyestra-1,3,5(10)-trien-17-yl decanoate

Systematic Name

English

Estra-1,3,5(10)-triene-3,17-diol (17β)-, 17-decanoate

Systematic Name

English

ESTRADIOL-17BETA-DECANOATE RN

Common Name

English

Code System Code Type Description

PUBCHEM

66409