DEOXYNORTRYPTOQUIVALINE

Details

Stereochemistry	MIXED
Molecular Formula	C28H28N4O6
Molecular Weight	516.5451
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)C(OC(C)=O)C1=NC2=C(C=CC=C2)C(=O)N1C3CC4(OC3=O)C5NC(C)C(=O)N5C6=C4C=CC=C6

InChI

InChIKey=UQWRSTHNSHDTCA-UHFFFAOYSA-N

InChI=1S/C28H28N4O6/c1-14(2)22(37-16(4)33)23-30-19-11-7-5-9-17(19)25(35)31(23)21-13-28(38-26(21)36)18-10-6-8-12-20(18)32-24(34)15(3)29-27(28)32/h5-12,14-15,21-22,27,29H,13H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C28H28N4O6
Molecular Weight	516.5451
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:13:52 GMT 2025` Edited by `admin` on `Mon Mar 31 23:13:52 GMT 2025`
Record UNII	771386M36R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-DEOXY-2'-DEMETHYLTRYPTOQUIVALINE A

Preferred Name

English

DEOXYNORTRYPTOQUIVALINE

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-2'-METHYL-, (2'S-(2'.ALPHA.,9'.BETA.(4S*(R*)),9'A.ALPHA.))-

Systematic Name

English

Code System Code Type Description

FDA UNII

771386M36R

Created by admin on Mon Mar 31 23:13:52 GMT 2025 , Edited by admin on Mon Mar 31 23:13:52 GMT 2025

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EPA CompTox

DTXSID70976107

Created by admin on Mon Mar 31 23:13:52 GMT 2025 , Edited by admin on Mon Mar 31 23:13:52 GMT 2025

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CAS

60676-58-6

Created by admin on Mon Mar 31 23:13:52 GMT 2025 , Edited by admin on Mon Mar 31 23:13:52 GMT 2025

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PUBCHEM

185989

Created by admin on Mon Mar 31 23:13:52 GMT 2025 , Edited by admin on Mon Mar 31 23:13:52 GMT 2025

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