PTEROPTERIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H33N9O12
Molecular Weight	699.6254
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC2=C(N=C(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)C(O)=O)C=N2)C(=O)N1

InChI

InChIKey=WOLQREOUPKZMEX-BZSNNMDCSA-N

InChI=1S/C29H33N9O12/c30-29-37-23-22(25(44)38-29)33-15(12-32-23)11-31-14-3-1-13(2-4-14)24(43)36-18(28(49)50)6-9-20(40)34-16(26(45)46)5-8-19(39)35-17(27(47)48)7-10-21(41)42/h1-4,12,16-18,31H,5-11H2,(H,34,40)(H,35,39)(H,36,43)(H,41,42)(H,45,46)(H,47,48)(H,49,50)(H3,30,32,37,38,44)/t16-,17-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H33N9O12
Molecular Weight	699.6254
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
George Herman "Babe" Ruth Jr: baseball star and early participant in a cancer clinical trial.	2008 Nov	19004136

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:22:28 GMT 2023` Edited by `admin` on `Fri Dec 15 15:22:28 GMT 2023`
Record UNII	0YK15S31J3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PTEROPTERIN

Common Name

English

N-(N-(N-PTEROYL-.GAMMA.-GLUTAMYL)-.GAMMA.-GLUTAMYL)GLUTAMIC ACID

Common Name

English

PTEROYLTRIGLUTAMIC ACID

Common Name

English

TEROPTERIN

Common Name

English

N-(4-(((2-AMINO-3,4-DIHYDRO-4-OXO-6-PTERIDINYL)METHYL)AMINO)BENZOYL)-L-.GAMMA.-GLUTAMYL-L-.GAMMA.-GLUTAMYL-L-GLUTAMIC ACID

Common Name

English

PTEROYLDI-.GAMMA.-GLUTAMYLGLUTAMIC ACID

Common Name

English

CASEI FACTOR

Common Name

English

FERMENTATION L

Common Name

English

PTEROPTERIN [MI]

Common Name

English

PTGA

Common Name

English

PTEROLYL-.GAMMA.-GLUTAMYL-.GAMMA.-GLUTAMYLGLUTAMIC ACID

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C511