CBP-501

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C86H122F5N29O17
Molecular Weight	1929.065
Optical Activity	UNSPECIFIED
Defined Stereocenters	12 / 12
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N[C@H](CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2)C(=O)N[C@H](CO)C(=O)N[C@H](CC3=CNC4=C3C=CC=C4)C(=O)N[C@H](CO)C(=O)N[C@H](CC5=C(F)C(F)=C(F)C(F)=C5F)C(=O)N[C@H](CC6CCCCC6)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCNC(N)=N)C(O)=O

InChI

InChIKey=DEZJGRPRBZSAKI-KMGSDFBDSA-N

InChI=1S/C86H122F5N29O17/c87-64-49(65(88)67(90)68(91)66(64)89)39-60(118-80(135)62(42-122)120-77(132)59(38-47-40-109-51-19-8-7-18-48(47)51)117-79(134)61(41-121)119-70(125)50(92)36-44-25-27-46(28-26-44)69(124)45-16-5-2-6-17-45)78(133)116-58(37-43-14-3-1-4-15-43)76(131)113-54(22-11-33-106-84(98)99)72(127)110-52(20-9-31-104-82(94)95)71(126)111-53(21-10-32-105-83(96)97)73(128)114-56(29-30-63(93)123)75(130)112-55(23-12-34-107-85(100)101)74(129)115-57(81(136)137)24-13-35-108-86(102)103/h2,5-8,16-19,25-28,40,43,50,52-62,109,121-122H,1,3-4,9-15,20-24,29-39,41-42,92H2,(H2,93,123)(H,110,127)(H,111,126)(H,112,130)(H,113,131)(H,114,128)(H,115,129)(H,116,133)(H,117,134)(H,118,135)(H,119,125)(H,120,132)(H,136,137)(H4,94,95,104)(H4,96,97,105)(H4,98,99,106)(H4,100,101,107)(H4,102,103,108)/t50-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C86H122F5N29O17
Molecular Weight	1929.065
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	12 / 12
E/Z Centers	4
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:28:41 UTC 2023` Edited by `admin` on `Fri Dec 15 15:28:41 UTC 2023`
Record UNII	XH2662798I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CBP-501

Common Name

English

CBP 501 [WHO-DD]

Common Name

English

D-ARGININE, 4-BENZOYL-D-PHENYLALANYL-D-SERYL-D-TRYPTOPHYL-D-SERYL-2,3,4,5,6-PENTAFLUORO-D-PHENYLALANYL-3-CYCLOHEXYL-D-ALANYL-D-ARGINYL-D-ARGINYL-D-ARGINYL-D-GLUTAMINYL-D-ARGINYL-

Common Name

English

CBP501

Code

English

Code System Code Type Description

PUBCHEM

16156006