.BETA.-ESTRADIOL DIBENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H32O4
Molecular Weight	480.5941
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .BETA.-ESTRADIOL DIBENZOATE

Structure Search

SMILES

[H][C@@]12CC[C@H](OC(=O)C3=CC=CC=C3)[C@@]1(C)CC[C@]4([H])C5=C(CC[C@@]24[H])C=C(OC(=O)C6=CC=CC=C6)C=C5

InChI

InChIKey=QSEBTTYLHXQXSF-CAHAWPIUSA-N

InChI=1S/C32H32O4/c1-32-19-18-26-25-15-13-24(35-30(33)21-8-4-2-5-9-21)20-23(25)12-14-27(26)28(32)16-17-29(32)36-31(34)22-10-6-3-7-11-22/h2-11,13,15,20,26-29H,12,14,16-19H2,1H3/t26-,27-,28+,29+,32+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C32H32O4
Molecular Weight	480.5941
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 06:50:03 GMT 2023` Edited by `admin` on `Sat Dec 16 06:50:03 GMT 2023`
Record UNII	65W00I5071
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.BETA.-ESTRADIOL DIBENZOATE

Common Name

English

ESTRADIOL, DIBENZOATE

Common Name

English

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

Common Name

English

ESTRADIOL 3,17-DIBENZOATE

Common Name

English

ESTRADIOL BENZOATE IMPURITY C [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

65W00I5071