amrubicin hydrochloride (Q27277373)

Amrubicin hydrochloride (English)

14 October 2016

chemical formula

C₂₅H₂₆ClNO₉

1 reference

Amrubicin hydrochloride (English)

14 October 2016

canonical SMILES

CC(=O)C1(CC(C2=C(C3=C(C(=C2C1)O)C(=O)C4=CC=CC=C4C3=O)O)OC5CC(C(CO5)O)O)N.Cl

1 reference

Amrubicin hydrochloride (English)

14 October 2016

isomeric SMILES

CC(=O)[C@]1(C[C@@H](C2=C(C3=C(C(=C2C1)O)C(=O)C4=CC=CC=C4C3=O)O)O[C@H]5C[C@@H]([C@@H](CO5)O)O)N.Cl

1 reference

Amrubicin hydrochloride (English)

InChI=1S/C25H25NO9.ClH/c1-10(27)25(26)7-13-18(16(8-25)35-17-6-14(28)15(29)9-34-17)24(33)20-19(23(13)32)21(30)11-4-2-3-5-12(11)22(20)31;/h2-5,14-17,28-29,32-33H,6-9,26H2,1H3;1H/t14-,15+,16-,17-,25-;/m0./s1

14 October 2016

Identifiers

InChI

1 reference

Amrubicin hydrochloride (English)

14 October 2016

1 reference

Global Substance Registration System

Amrubicin hydrochloride (English)

14 October 2016

2 references

UNII

EUL6MP8FZW

amrubicin hydrochloride (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=110311-30-3

8 April 2021

1 reference

Amrubicin hydrochloride (English)

14 October 2016

1 reference

Amrubicin hydrochloride (English)

14 October 2016

1 reference

matched by identifier from

AMRUBICIN HYDROCHLORIDE (English)

14 October 2016

2 references

inferred from InChIKey

DSSTOX compound identifier

1 reference

0 references

0 references

2 references

Global Substance Registration System

UNII

EUL6MP8FZW

amrubicin hydrochloride (English)

matched by identifier from

14 October 2016