FLUOROETHYLDIPRENORPHINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H36FNO4
Molecular Weight	457.5774
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12OC3=C(O)C=CC4=C3[C@@]15CCN(CC6CC6)[C@]([H])(C4)[C@]57CC[C@@]2(OCCF)[C@H](C7)C(C)(C)O

InChI

InChIKey=VKHMXTVEQIZBFB-JZGHPPSWSA-N

InChI=1S/C27H36FNO4/c1-24(2,31)19-14-25-7-8-27(19,32-12-10-28)23-26(25)9-11-29(15-16-3-4-16)20(25)13-17-5-6-18(30)22(33-23)21(17)26/h5-6,16,19-20,23,30-31H,3-4,7-15H2,1-2H3/t19-,20-,23-,25-,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H36FNO4
Molecular Weight	457.5774
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 00:42:12 UTC 2023` Edited by `admin` on `Sat Dec 16 00:42:12 UTC 2023`
Record UNII	BTQ82Y9RXZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

FLUOROETHYLDIPRENORPHINE

Common Name

English

FDPN

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID00160936

Created by admin on Sat Dec 16 00:42:12 UTC 2023 , Edited by admin on Sat Dec 16 00:42:12 UTC 2023

PRIMARY

PUBCHEM

71588001

Created by admin on Sat Dec 16 00:42:12 UTC 2023 , Edited by admin on Sat Dec 16 00:42:12 UTC 2023

PRIMARY

FDA UNII

BTQ82Y9RXZ

Created by admin on Sat Dec 16 00:42:12 UTC 2023 , Edited by admin on Sat Dec 16 00:42:12 UTC 2023

PRIMARY

CAS

1391522-66-9

Created by admin on Sat Dec 16 00:42:12 UTC 2023 , Edited by admin on Sat Dec 16 00:42:12 UTC 2023

PRIMARY