F-992

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C45H65N13O11S2
Molecular Weight	1028.208
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@]1(C)NC(=O)[C@H](CC2=CC=CS2)NC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)CCCSC[C@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)N4C[C@H](O)C[C@H]4C(=O)N[C@H](CCCNC(N)=N)C(=O)NCC(N)=O

InChI

InChIKey=QWIZXUKSCAJBBY-NDJSDKDCSA-N

InChI=1S/C45H65N13O11S2/c1-3-45(2)43(69)56-31(21-34(46)60)39(65)55-32(42(68)58-23-26(59)19-33(58)41(67)53-28(13-7-15-50-44(48)49)37(63)51-22-35(47)61)24-70-16-9-14-36(62)52-29(18-25-10-5-4-6-11-25)38(64)54-30(40(66)57-45)20-27-12-8-17-71-27/h4-6,8,10-12,17,26,28-33,59H,3,7,9,13-16,18-24H2,1-2H3,(H2,46,60)(H2,47,61)(H,51,63)(H,52,62)(H,53,67)(H,54,64)(H,55,65)(H,56,69)(H,57,66)(H4,48,49,50)/t26-,28-,29-,30+,31+,32+,33+,45+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C45H65N13O11S2
Molecular Weight	1028.208
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 16:38:53 UTC 2023` Edited by `admin` on `Sat Dec 16 16:38:53 UTC 2023`
Record UNII	N39Q2H8V0B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

F-992

Code

English

F992

Code

English

(D-PHE2, THI3,A-ME-ABU4, HYP7, D-ARG8)-DC1-VASOPRESSIN

Common Name

English

GLYCINAMIDE, N-(4-MERCAPTO-1-OXOBUTYL)-D-PHENYLALANYL-3-(2-THIENYL)-L-ALANYL-L-ISOVALYL-L-ASPARAGINYL-L-CYSTEINYL-(4R)-4-HYDROXY-L-PROLYL-D-ARGINYL-, CYCLIC (1->5)-THIOETHER

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID401026273

Created by admin on Sat Dec 16 16:38:53 UTC 2023 , Edited by admin on Sat Dec 16 16:38:53 UTC 2023

PRIMARY

FDA UNII

N39Q2H8V0B

Created by admin on Sat Dec 16 16:38:53 UTC 2023 , Edited by admin on Sat Dec 16 16:38:53 UTC 2023

PRIMARY

CAS

162277-99-8

Created by admin on Sat Dec 16 16:38:53 UTC 2023 , Edited by admin on Sat Dec 16 16:38:53 UTC 2023

PRIMARY

PUBCHEM

9876525

Created by admin on Sat Dec 16 16:38:53 UTC 2023 , Edited by admin on Sat Dec 16 16:38:53 UTC 2023

PRIMARY

Related Record Type Details


					N39Q2H8V0B

F-992

ACTIVE MOIETY

Comments:

Vasopressin receptor agonists

Amount: