TRYPTOQUIVALINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H30N4O7
Molecular Weight	546.5711
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N(O)C(C)(C)C(=O)N1C3=CC=CC=C3[C@@]24C[C@@H](N5C(=O)C6=C(C=CC=C6)N=C5[C@@H](OC(C)=O)C(C)C)C(=O)O4

InChI

InChIKey=CYNVLFGDEQQUPE-LDWWEUSWSA-N

InChI=1S/C29H30N4O7/c1-15(2)22(39-16(3)34)23-30-19-12-8-6-10-17(19)24(35)31(23)21-14-29(40-25(21)36)18-11-7-9-13-20(18)32-26(29)33(38)28(4,5)27(32)37/h6-13,15,21-22,26,38H,14H2,1-5H3/t21-,22+,26+,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H30N4O7
Molecular Weight	546.5711
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Chrysin blocks topotecan-induced apoptosis in Caco-2 cells in spite of inhibition of ABC-transporters.	2010 Aug 15	20457140
Assessment of ABCG2-mediated transport of xenobiotics across the blood-milk barrier of dairy animals using a new MDCKII in vitro model.	2013 Sep	23652544

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:43:28 GMT 2023` Edited by `admin` on `Fri Dec 15 19:43:28 GMT 2023`
Record UNII	CW5S8OP3VO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TRYPTOQUIVALINE

Common Name

English

SPIRO(FURAN-2(5H),9'-(9H)IMIDAZO(1,2-A)INDOLE)-3',5(2'H)-DIONE, 4-(2-(1-(ACETYLOXY)-2-METHYLPROPYL)-4-OXO-3(4H)-QUINAZOLINYL)-1',3,4,9'A-TETRAHYDRO-1'-HYDROXY-2',2'-DIMETHYL-, (9'S-(9'.ALPHA.(4S*(R*)),9'A.BETA.))-

Common Name

English

SPIRO(FURAN-2(5H),9'-(9H)IMIDAZO(1,2-A)INDOLE)-3',5(2'H)-DIONE, 4-(2-((1S)-1-(ACETYLOXY)-2-METHYLPROPYL)-4-OXO-3(4H)-QUINAZOLINYL)-1',3,4,9'A-TETRAHYDRO-1'-HYDROXY-2',2'-DIMETHYL-, (2S,4R,9'AS)-

Common Name

English

TRYPTOQUIVALINE C

Common Name

English

FUMITREMORGIN C

Common Name

English

TRYPTOQUIVALINE A

Common Name

English

Code System Code Type Description

FDA UNII

CW5S8OP3VO