(Q27132193)

{Methyl 3-[(2R,5'S)-5'-hydroxy-5',10',15',19'-tetramethyl-5-oxo-9',14'-divinyl-4,5-dihydro-3H-spiro[furan-2,4'-[21,22,23,24]tetraazapentacyclo[16.2.1.1~3,6~.1~8,11~.1~13,16~]tetracosa[1,3(24),6,8,10,1 (English)

retrieved

7 October 2016

chemical formula

C₃₅H₃₄FeN₄O₅

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C=CC1=C(C)C2=CC=3C(C)=C(CCC(=O)OC)C(=CC=4C5(CCC(=O)O5)C(C)(C(=CC6=C(C=C)C(C)=C(C=C1[N-]2)[N-]6)N4)O)N3.[Fe+2]

1 reference

language of work or name

English

title

cis-heme d hydroxychlorin gamma-spirolactone methyl ester (English)

retrieved

7 October 2016

isomeric SMILES

C=CC1=C(C)C2=CC=3C(C)=C(CCC(=O)OC)C(=CC=4[C@]5(CCC(=O)O5)[C@](C)(C(=CC6=C(C=C)C(C)=C(C=C1[N-]2)[N-]6)N4)O)N3.[Fe+2]

1 reference

language of work or name

English

title

cis-heme d hydroxychlorin gamma-spirolactone methyl ester (English)

retrieved

7 October 2016

Identifiers

InChI

InChI=1S/C35H34N4O5.Fe/c1-8-21-18(3)24-14-25-20(5)23(10-11-32(40)43-7)29(38-25)17-31-35(13-12-33(41)44-35)34(6,42)30(39-31)16-28-22(9-2)19(4)26(37-28)15-27(21)36-24;/h8-9,14-17,42H,1-2,10-13H2,3-7H3;/q-2;+2/t34-,35+;/m0./s1

1 reference

language of work or name

English

title

cis-heme d hydroxychlorin gamma-spirolactone methyl ester (English)

retrieved

7 October 2016

InChIKey

HSOAODYTIXUNJD-PFHIRXQESA-N

2 references

language of work or name

English

title

cis-heme d hydroxychlorin gamma-spirolactone methyl ester (English)

retrieved

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

language of work or name

English

title

{Methyl 3-[(2R,5'S)-5'-hydroxy-5',10',15',19'-tetramethyl-5-oxo-9',14'-divinyl-4,5-dihydro-3H-spiro[furan-2,4'-[21,22,23,24]tetraazapentacyclo[16.2.1.1~3,6~.1~8,11~.1~13,16~]tetracosa[1,3(24),6,8,10,1 (English)

7 October 2016

1 reference

26 December 2021