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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 of F-992

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

Approval Year

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 GMT 2023 , Edited by admin on Sat Dec 16 16:38:53 GMT 2023
PRIMARY
FDA UNII
N39Q2H8V0B
Created by admin on Sat Dec 16 16:38:53 GMT 2023 , Edited by admin on Sat Dec 16 16:38:53 GMT 2023
PRIMARY
CAS
162277-99-8
Created by admin on Sat Dec 16 16:38:53 GMT 2023 , Edited by admin on Sat Dec 16 16:38:53 GMT 2023
PRIMARY
PUBCHEM
9876525
Created by admin on Sat Dec 16 16:38:53 GMT 2023 , Edited by admin on Sat Dec 16 16:38:53 GMT 2023
PRIMARY