Androst-16-en-3-ol, 5,6-epoxy-17-(3-pyridinyl)-, 3-acetate, (3β,5β,6β)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H33NO3
Molecular Weight	407.5451
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Androst-16-en-3-ol, 5,6-epoxy-17-(3-pyridinyl)-, 3-acetate, (3β,5β,6β)-

Structure Search

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])CC=C(C5=CN=CC=C5)[C@@]4(C)CC[C@]3([H])[C@@]6(C)CC[C@@H](C[C@@]16O2)OC(C)=O

InChI

InChIKey=HIXCRYBQWBGPEX-KRTLOZRNSA-N

InChI=1S/C26H33NO3/c1-16(28)29-18-8-11-25(3)22-9-10-24(2)20(17-5-4-12-27-15-17)6-7-21(24)19(22)13-23-26(25,14-18)30-23/h4-6,12,15,18-19,21-23H,7-11,13-14H2,1-3H3/t18-,19-,21-,22-,23+,24+,25+,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C26H33NO3
Molecular Weight	407.5451
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:52:24 GMT 2023` Edited by `admin` on `Sat Dec 16 19:52:24 GMT 2023`
Record UNII	C4VAP5P4U2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Androst-16-en-3-ol, 5,6-epoxy-17-(3-pyridinyl)-, 3-acetate, (3β,5β,6β)-

Systematic Name

English

(3S,4aS,5aR,6aS,6bS,9aS,11aS,11bR)-9a,11b-Dimethyl-9-(pyridin-3-yl)-1,2,3,4,5a,6,6a,6b,7,9a,10,11,11a,11b-tetradecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-3-yl acetate

Systematic Name

English

Code System Code Type Description

CAS

1868064-76-9

Created by admin on Sat Dec 16 19:52:24 GMT 2023 , Edited by admin on Sat Dec 16 19:52:24 GMT 2023

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FDA UNII

C4VAP5P4U2

Created by admin on Sat Dec 16 19:52:24 GMT 2023 , Edited by admin on Sat Dec 16 19:52:24 GMT 2023

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