NIKKOMYCIN I

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H32N6O13
Molecular Weight	624.554
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]([C@H](N)C(=O)N[C@@H]([C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=C(NC2=O)C=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[C@H](O)C3=CC=C(O)C=N3

InChI

InChIKey=LCKTVQPHDUFHML-LXZPMYIBSA-N

InChI=1S/C25H32N6O13/c1-9(17(36)12-3-2-11(33)6-27-12)15(26)21(39)30-16(22(40)29-13(24(41)42)4-5-14(34)35)20-18(37)19(38)23(44-20)31-7-10(8-32)28-25(31)43/h2-3,6-9,13,15-20,23,33,36-38H,4-5,26H2,1H3,(H,28,43)(H,29,40)(H,30,39)(H,34,35)(H,41,42)/t9-,13-,15-,16-,17-,18-,19+,20+,23+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H32N6O13
Molecular Weight	624.554
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:56:02 GMT 2025` Edited by `admin` on `Mon Mar 31 21:56:02 GMT 2025`
Record UNII	68CGX2YYPQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NIKKOMYCIN I

Common Name

English

(3S,4S)-4-(5-HYDROXY-2-PYRIDINYL)-3-METHYL-L-HOMOSERYL-(6R)-2-AMINO-3,6-ANHYDRO-2-DEOXY-6-C-(4-FORMYL-2,3-DIHYDRO-2-OXO-1H-IMIDAZOL-1-YL)-L-ALLONOYL-L-GLUTAMIC ACID

Preferred Name

English

L-GLUTAMIC ACID, (3S,4S)-4-HYDROXY-4-(5-HYDROXY-2-PYRIDINYL)-L-VALYL-(6R)-2-AMINO-3,6-ANHYDRO-2-DEOXY-6-C-(4-FORMYL-2,3-DIHYDRO-2-OXO-1H-IMIDAZOL-1-YL)-L-ALLONOYL-

Systematic Name

English

L-GLUTAMIC ACID, N-(L-2-(5-(4-FORMYL-2,3-DIHYDRO-2-OXO-1H-IMIDAZOL-1-YL)TETRAHYDRO-3,4-DIHYDROXY-2-FURANYL)-N-((3S,4S)-4-HYDROXY-4-(5-HYDROXY-2-PYRIDINYL)-L-VALYL)GLYCYL)-, (2R-(2.ALPHA.,3.BETA.,4.BETA.,5.ALPHA.))-

Systematic Name

English

Code System Code Type Description

FDA UNII

68CGX2YYPQ

Created by admin on Mon Mar 31 21:56:02 GMT 2025 , Edited by admin on Mon Mar 31 21:56:02 GMT 2025

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PUBCHEM

101283376

Created by admin on Mon Mar 31 21:56:02 GMT 2025 , Edited by admin on Mon Mar 31 21:56:02 GMT 2025

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