15,16-dihydrobiliverdin (Q27102078)

21H-Biline-8,12-dipropanoic acid, 2,17-diethenyl-1,4,5,19,23,24-hexahydro-3,7,13,18-tetramethyl- 1,19-dioxo-, (4R)- (English)

19 October 2016

chemical formula

C₃₃H₃₆N₄O₆

1 reference

stated in

RCSB protein data bank

PDB ligand ID

DBV

16 February 2021

canonical SMILES

C=CC1=C(C)C(=NC1=C(C2=C(C)C(CCC(=O)O)=C(C(=C3C(CCC(=O)O)=C(C)C(CC4(C(C)=C(C=C)C(=N4)O)[H])=N3)[H])N2)[H])O

1 reference

15,16-dihydrobiliverdin (English)

19 October 2016

isomeric SMILES

C=CC/1=C(C)C(=N\C1=C(/C2=C(C)C(CCC(=O)O)=C(\C(=C/3\C(CCC(=O)O)=C(C)C(C[C@@]4(C(C)=C(C=C)C(=N4)O)[H])=N3)\[H])N2)\[H])O

1 reference

15,16-dihydrobiliverdin (English)

InChI=1S/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,14-15,26,35H,1-2,9-13H2,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b27-14-,28-15-/t26-/m1/s1

19 October 2016

Identifiers

InChI

1 reference

15,16-dihydrobiliverdin (English)

ZQHDSLZHMAUUQK-ZTYGKHTCSA-N

19 October 2016

InChIKey

2 references

15,16-dihydrobiliverdin (English)

19 October 2016

stated in

ChEBI release 2020-09-01

0 references

1 reference

21H-Biline-8,12-dipropanoic acid, 2,17-diethenyl-1,4,5,19,23,24-hexahydro-3,7,13,18-tetramethyl- 1,19-dioxo-, (4R)- (English)

19 October 2016

ChEBI ID

16790

mapping relation type

2 references

15,16-dihydrobiliverdin (English)

19 October 2016

stated in

ChEBI release 2019-10-02

SureChEMBL ID

SCHEMBL5144761

1 reference

based on heuristic

inferred from InChIKey

0 references

0 references

1 reference

4LMX (English)

19 October 2016

1 reference

4LM6 (English)

19 October 2016

1 reference

1XG0 (English)

19 October 2016

1 reference

1QGW (English)

19 October 2016

1 reference

4LMS (English)

19 October 2016

1 reference

1XF6 (English)