.DELTA.6,7-ESTRADIOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H22O2
Molecular Weight	270.3661
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=VVLCELUSWGWMSW-ZBRFXRBCSA-N

InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,14-17,19-20H,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H22O2
Molecular Weight	270.3661
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 08:20:05 GMT 2023` Edited by `admin` on `Sat Dec 16 08:20:05 GMT 2023`
Record UNII	N4K670423X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.DELTA.6,7-ESTRADIOL

Common Name

English

ESTRADIOL RELATED COMPOUND B [USP-RS]

Common Name

English

6,7-DEHYDRO ESTRADIOL

Common Name

English

NSC-57430

Code

English

C14590

Code

English

ESTRA-1,3,5(10)-6-TETRAEN-3,17.BETA.-DIOL

Systematic Name

English

ESTRA-1,3,5(10),6-TETRAENE-3,17-DIOL, (17.BETA.)-

Systematic Name

English

ESTRA-1,3,5(10),6-TETRAENE-3,17-DIOL,(17.BETA.)-

Common Name

English

(17.BETA.)-ESTRA-1,3,5(10),6-TETRENE-3,17-DIOL

Systematic Name

English

J112.451J

Code

English

DELTA 6 E2

Common Name

English

(8R,9S,13S,14S,17S)-13-METHYL-8,9,11,12,14,15,16,17-OCTAHYDROCYCLOPENTA(A)PHENANTHRENE-3,17-DIOL

Systematic Name

English

6-DEHYDROESTRADIOL

Common Name

English

6-DEHYDRO-17.BETA.-ESTRADIOL

Common Name

English

6,7-DIDEHYDRO-17.BETA.-ESTRADIOL

Common Name

English

ESTRADIOL RELATED COMPOUND B

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID10993691