(Q27132197)

{3,3'-[(2R,3S)-2,3-Dihydroxy-3,8,13,17-tetramethyl-7,12-divinyl-2,3-dihydroporphyrin-2,18-diyl-kappa~4~N~21~,N~22~,N~23~,N~24~]dipropanoato(4-)}ferrate(2-) (English)

retrieved

7 October 2016

stereoisomer of

heme d trans-diol(2-)

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₄H₃₂FeN₄O₆²⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C=CC1=C(C)C2=CC3=C(C)C(CCC(=O)[O-])=C(C=C4C(CCC(=O)[O-])(C(C)(C(C=C5C(C=C)=C(C)C(=CC1=N2)[N-]5)=N4)O)O)[N-]3.[Fe+2]

1 reference

language of work or name

English

title

heme d cis-diol(2-) (English)

retrieved

7 October 2016

isomeric SMILES

C=CC1=C(C)C2=CC3=C(C)C(CCC(=O)[O-])=C(C=C4[C@](CCC(=O)[O-])([C@](C)(C(C=C5C(C=C)=C(C)C(=CC1=N2)[N-]5)=N4)O)O)[N-]3.[Fe+2]

1 reference

language of work or name

English

title

heme d cis-diol(2-) (English)

retrieved

7 October 2016

Identifiers

InChI

InChI=1S/C34H36N4O6.Fe/c1-7-20-17(3)23-13-24-19(5)22(9-10-31(39)40)28(37-24)16-30-34(44,12-11-32(41)42)33(6,43)29(38-30)15-27-21(8-2)18(4)25(36-27)14-26(20)35-23;/h7-8,13-16,43-44H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-4/t33-,34+;/m0./s1

1 reference

language of work or name

English

title

heme d cis-diol(2-) (English)

retrieved

7 October 2016

InChIKey

GFRHEDKPMCXPFU-XCVPDAMTSA-J

2 references

language of work or name

English

title

heme d cis-diol(2-) (English)

retrieved

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

language of work or name

English

title

{3,3'-[(2R,3S)-2,3-Dihydroxy-3,8,13,17-tetramethyl-7,12-divinyl-2,3-dihydroporphyrin-2,18-diyl-kappa~4~N~21~,N~22~,N~23~,N~24~]dipropanoato(4-)}ferrate(2-) (English)

7 October 2016

2 references

26 December 2021

matched by identifier from