theophylline/ephedrine (Q27283071)

UNII-LMS3EG69X8 (English)

reason for deprecated rank

14 October 2016

345.3969 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₂₃N₅O₃

value is not applicable for a mixture

2 references

UNII-LMS3EG69X8 (English)

14 October 2016

CC(C(C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)NC=N2

1 reference

UNII-LMS3EG69X8 (English)

14 October 2016

isomeric SMILES

C[C@@H]([C@@H](C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)NC=N2

1 reference

InChI=1S/C10H15NO.C7H8N4O2/c1-8(11-2)10(12)9-6-4-3-5-7-9;1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3-8,10-12H,1-2H3;3H,1-2H3,(H,8,9)/t8-,10-;/m0./s1

UNII-LMS3EG69X8 (English)

14 October 2016

0 references

0 references

Identifiers

InChI

1 reference

UNII-LMS3EG69X8 (English)

QCGRAEADKWZHRR-GNAZCLTHSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-LMS3EG69X8 (English)

14 October 2016

1 reference

UNII

LMS3EG69X8

theophylline ephedrine (English)

14 October 2016

1 reference

theophylline ephedrine (English)

14 October 2016

2 references

UNII-LMS3EG69X8 (English)

matched by identifier from

14 October 2016

InChIKey

QCGRAEADKWZHRR-GNAZCLTHSA-N

1 reference

2 references

Global Substance Registration System

UNII

LMS3EG69X8

theophylline ephedrine (English)