TALIRINE MALEIMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C60H64N8O12
Molecular Weight	1089.1966
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC(=CN1C(=O)C3=CC(OC)=C(OCCCOC4=C(OC)C=C5C(=C4)N=C[C@]6([H])CC(=CN6C5=O)C7=CC=C(OC)C=C7)C=C3N=C2)C8=CC=C(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCN9C(=O)C=CC9=O)C(C)C)C=C8

InChI

InChIKey=TWQIMWSQDICMSE-DGCIIGOYSA-N

InChI=1S/C60H64N8O12/c1-35(2)56(65-53(69)11-8-7-9-22-66-54(70)20-21-55(66)71)58(73)63-36(3)57(72)64-41-16-12-37(13-17-41)39-25-42-31-61-47-29-51(49(77-5)27-45(47)59(74)67(42)33-39)79-23-10-24-80-52-30-48-46(28-50(52)78-6)60(75)68-34-40(26-43(68)32-62-48)38-14-18-44(76-4)19-15-38/h12-21,27-36,42-43,56H,7-11,22-26H2,1-6H3,(H,63,73)(H,64,72)(H,65,69)/t36-,42-,43-,56-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C60H64N8O12
Molecular Weight	1089.1966
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:09:41 GMT 2023` Edited by `admin` on `Sat Dec 16 11:09:41 GMT 2023`
Record UNII	1Y234W15BL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TALIRINE MALEIMIDE

Common Name

English

MC-VAL-ALA-PBD

Common Name

English

TALIRINE

Common Name

English

N-(6-(3-MERCAPTO-2,5-DIOXO-1-PYRROLIDINYL)-1-OXOHEXYL)-L-VALYL-N-(4-((11AS)-8-(3(((11AS)-5,11A-DIHYDRO-7-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIAZEPINE-8-YL)OXY)PROPOXY)-5,11A-DIHYDRO-7-METHOXY-5-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIA

Systematic Name

English

TALIRINE, MALEIMIDE-

Common Name

English

L-ALANINAMIDE, N-(6-(2,5-DIHYDRO-2,5-DIOXO-1H-PYRROL-1-YL)-1-OXOHEXYL)-L-VALYL-N-(4-((11AS)-8-(3-(((11AS)-5,11A-DIHYDRO-7-METHOXY-2-(4-METHOXYPHENYL)-5-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIAZEPIN-8-YL)OXY)PROPOXY)-5,11A-DIHYDRO-7-METHOXY-5-OXO-1H-PYRROLO(2,1

Systematic Name

English

TALIRINE PYRROLE-2,5-DIONE

Common Name

English

SGD-1910

Code

English

Code System Code Type Description

SMS_ID

100000181297