Boc-Gln-Ala-Arg-7-amino-4-methylcoumarin (Q27158101)

113866-20-9 (English)

9 October 2016

chemical formula

C₂₉H₄₂N₈O₈

1 reference

113866-20-9 (English)

9 October 2016

canonical SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(C)NC(=O)C(CCC(=O)N)NC(=O)OC(C)(C)C

1 reference

113866-20-9 (English)

9 October 2016

isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N)NC(=O)OC(C)(C)C

1 reference

113866-20-9 (English)

InChI=1S/C29H42N8O8/c1-15-13-23(39)44-21-14-17(8-9-18(15)21)35-26(42)19(7-6-12-33-27(31)32)36-24(40)16(2)34-25(41)20(10-11-22(30)38)37-28(43)45-29(3,4)5/h8-9,13-14,16,19-20H,6-7,10-12H2,1-5H3,(H2,30,38)(H,34,41)(H,35,42)(H,36,40)(H,37,43)(H4,31,32,33)/t16-,19-,20-/m0/s1

9 October 2016

Identifiers

InChI

1 reference

113866-20-9 (English)

LQSLBVXESNRILG-VDGAXYAQSA-N

9 October 2016

InChIKey

2 references

113866-20-9 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

N~2~-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-glutaminyl-L-alanyl-N-(4-methyl-2-oxo-2H-chromen-7-yl)-L-argininamide (English)

9 October 2016

2 references

113866-20-9 (English)

matched by identifier from

9 October 2016

InChIKey

LQSLBVXESNRILG-VDGAXYAQSA-N

Reaxys registry number

8818380

1 reference

Boc-Gln-Ala-Arg-7-amino-4-methylcoumarin (English)

9 October 2016

ChEBI ID

84832

mapping relation type

2 references

Boc-Gln-Ala-Arg-7-amino-4-methylcoumarin (English)