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Details

Stereochemistry ABSOLUTE
Molecular Formula C46H65N15O12S2
Molecular Weight 1090.256
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VASOPRESSIN H-3

SMILES

[3H]C1=CC(C[C@@H]2NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC2=O)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)=CC([3H])=C1[3H]

InChI

InChIKey=KBZOIRJILGZLEJ-QQMYEBLASA-N
InChI=1S/C46H65N15O12S2/c47-27-22-74-75-23-33(45(73)61-17-5-9-34(61)44(72)56-28(8-4-16-53-46(51)52)39(67)54-21-37(50)65)60-43(71)32(20-36(49)64)59-40(68)29(14-15-35(48)63)55-41(69)31(18-24-6-2-1-3-7-24)58-42(70)30(57-38(27)66)19-25-10-12-26(62)13-11-25/h1-3,6-7,10-13,27-34,62H,4-5,8-9,14-23,47H2,(H2,48,63)(H2,49,64)(H2,50,65)(H,54,67)(H,55,69)(H,56,72)(H,57,66)(H,58,70)(H,59,68)(H,60,71)(H4,51,52,53)/t27-,28-,29-,30-,31-,32-,33-,34-/m0/s1/i1T,2T,3T

HIDE SMILES / InChI

Molecular Formula C46H65N15O12S2
Molecular Weight 1090.256
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 20:09:19 GMT 2023
Edited
by admin
on Sat Dec 16 20:09:19 GMT 2023
Record UNII
Z9RG9QT23C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VASOPRESSIN H-3
Common Name English
[3H]AVP
Common Name English
ARGININE VASOPRESSIN H-3
Common Name English
Vasopressin, 3-(L-phenyl-3,4,5-t3-alanine)-8-L-arginine-
Common Name English
Code System Code Type Description
CAS
316808-15-8
Created by admin on Sat Dec 16 20:09:20 GMT 2023 , Edited by admin on Sat Dec 16 20:09:20 GMT 2023
PRIMARY
FDA UNII
Z9RG9QT23C
Created by admin on Sat Dec 16 20:09:20 GMT 2023 , Edited by admin on Sat Dec 16 20:09:20 GMT 2023
PRIMARY
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