VIPIVOTIDE TETRAXETAN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C49H71N9O16
Molecular Weight	1042.1387
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)[C@H](CC1=CC=C2C=CC=CC2=C1)NC(=O)[C@H]3CC[C@H](CNC(=O)CN4CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC4)CC3)C(O)=O)C(O)=O

InChI

InChIKey=JBHPLHATEXGMQR-LFWIOBPJSA-N

InChI=1S/C49H71N9O16/c59-40(28-55-17-19-56(29-42(62)63)21-23-58(31-44(66)67)24-22-57(20-18-55)30-43(64)65)51-27-32-8-12-35(13-9-32)45(68)52-39(26-33-10-11-34-5-1-2-6-36(34)25-33)46(69)50-16-4-3-7-37(47(70)71)53-49(74)54-38(48(72)73)14-15-41(60)61/h1-2,5-6,10-11,25,32,35,37-39H,3-4,7-9,12-24,26-31H2,(H,50,69)(H,51,59)(H,52,68)(H,60,61)(H,62,63)(H,64,65)(H,66,67)(H,70,71)(H,72,73)(H2,53,54,74)/t32-,35-,37-,38-,39-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C49H71N9O16
Molecular Weight	1042.1387
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:53:41 UTC 2023` Edited by `admin` on `Sat Dec 16 16:53:41 UTC 2023`
Record UNII	4YM1W0EGQ5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VIPIVOTIDE TETRAXETAN

Official Name

English

L-LYSINE, N2-((((1S)-1,3-DICARBOXYPROPYL)AMINO)CARBONYL)-N6-(3-(2-NAPHTHALENYL)-N-(2-(4,7,10-TRIS(CARBOXYMETHYL)-1,4,7,10-TETRAAZACYCLODODEC-1-YL)ACETYL)-L-ALANYL-TRANS-4-(AMINOMETHYL)CYCLOHEXANECARBONYL)-

Systematic Name

English

-LYSINE, N2-((((1S)-1,3-DICARBOXYPROPYL)AMINO)CARBONYL)-N6-(3-(2-NAPHTHALENYL)-N-((TRANS-4-(((2-(4,7,10-TRIS(CARBOXYMETHYL)-1,4,7,10-TETRAAZACYCLODODEC-1-YL)ACETYL)AMINO)METHYL)CYCLOHEXYL)CARBONYL)--ALANYL)-

Systematic Name

English

DKFZ-PSMA-617

Code

English

N-((N6-(3-(NAPHTHALEN-2-YL)-N-(TRANS-4-((2-(4,7,10-TRIS(CARBOXYMETHYL)-1,4,7,10-TETRAAZACYCLODODECAN-1-YL)ACETAMIDO)METHYL)CYCLOHEXANE-1-CARBONYL)-L-ALANYL)-LLYSIN-N2-YL)CARBONYL)-L-GLUTAMIC ACID

Systematic Name

English

vipivotide tetraxetan [INN]

Common Name

English

N2-((((1S)-1,3-DICARBOXYPROPYL)AMINO)CARBONYL)-N6-(3-(2-NAPHTHALENYL)-N-((TRANS-4-(((2-(4,7,10-TRIS(CARBOXYMETHYL)-1,4,7,10-TETRAAZACYCLODODEC-1-YL)ACETYL)AMINO)METHYL)CYCLOHEXYL)CARBONYL)-L-ALANYL)-L-LYSINE

Common Name

English

PSMA-617

Code

English

PSMA617

Code

English

VIPIVOTIDE TETRAXETAN [USAN]

Common Name

English

Code System Code Type Description

CAS

1702967-37-0