AOD-9604

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C78H123N23O23S2
Molecular Weight	1815.082
Optical Activity	UNSPECIFIED
Defined Stereocenters	15 / 15
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H]2CSSC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC2=O)C(C)C)C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(O)=O

InChI

InChIKey=GVIYUKXRXPXMQM-BPXGDYAESA-N

InChI=1S/C78H123N23O23S2/c1-9-41(8)62(101-68(115)47(18-14-28-86-78(83)84)91-69(116)50(29-38(2)3)95-63(110)45(79)30-43-19-21-44(104)22-20-43)75(122)100-61(40(6)7)74(121)94-49(23-25-56(80)105)67(114)98-55-37-126-125-36-54(65(112)88-32-57(106)89-51(76(123)124)31-42-15-11-10-12-16-42)97-70(117)52(34-102)90-58(107)33-87-64(111)48(24-26-59(108)109)93-73(120)60(39(4)5)99-71(118)53(35-103)96-66(113)46(92-72(55)119)17-13-27-85-77(81)82/h10-12,15-16,19-22,38-41,45-55,60-62,102-104H,9,13-14,17-18,23-37,79H2,1-8H3,(H2,80,105)(H,87,111)(H,88,112)(H,89,106)(H,90,107)(H,91,116)(H,92,119)(H,93,120)(H,94,121)(H,95,110)(H,96,113)(H,97,117)(H,98,114)(H,99,118)(H,100,122)(H,101,115)(H,108,109)(H,123,124)(H4,81,82,85)(H4,83,84,86)/t41-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,60-,61-,62-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C78H123N23O23S2
Molecular Weight	1815.082
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	15 / 15
E/Z Centers	7
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:22:29 GMT 2023` Edited by `admin` on `Sat Dec 16 11:22:29 GMT 2023`
Record UNII	7UP768IP4M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AOD-9604

Code

English

AOD9604

Code

English

L-PHENYLALANINE, L-TYROSYL-L-LEUCYL-L-ARGINYL-L-ISOLEUCYL-L-VALYL-L-GLUTAMINYL-L-CYSTEINYL-L-ARGINYL-L-SERYL-L-VALYL-L-.ALPHA.-GLUTAMYLGLYCYL-L-SERYL-L-CYSTEINYLGLYCYL-, CYCLIC (7->14)-DISULFIDE

Systematic Name

English

TYR-LEU-ARG-ILE-VAL-GLN-CYS-ARG-SER-VAL-GLU-GLY-SER-CYS-GLY-PHE CYCLIC (7->14)-DISULFIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

7UP768IP4M

Created by admin on Sat Dec 16 11:22:29 GMT 2023 , Edited by admin on Sat Dec 16 11:22:29 GMT 2023

PRIMARY

CAS

221231-10-3

Created by admin on Sat Dec 16 11:22:29 GMT 2023 , Edited by admin on Sat Dec 16 11:22:29 GMT 2023

PRIMARY

PUBCHEM

71300630

Created by admin on Sat Dec 16 11:22:29 GMT 2023 , Edited by admin on Sat Dec 16 11:22:29 GMT 2023

PRIMARY