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(Q27162411)
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English
epoxypheophorbide a
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
608.2634848719999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₃₅H₃₆N₄O₆
0 references
canonical SMILES
CCC1=C(C)C=2C3(C4(C(C=C)=C(C)C(=C(C=5C(C)(C(CCC(=O)O)(C(=C6C(C(C=7C(C)=C(C(=C1N2)[H])NC76)=O)(C(=O)OC)[H])N5)[H])[H])[H])N4)O3)[H]
1 reference
stated in
ChEBI
ChEBI ID
90228
language of work or name
English
title
epoxypheophorbide a
(English)
retrieved
9 October 2016
isomeric SMILES
CCC/1=C(C)C=2C3(C4(C(C=C)=C(C)/C(=C(/C=5[C@@](C)([C@](CCC(=O)O)(/C(=C/6\[C@](C(C=7C(C)=C(\C(=C1/N2)\[H])NC76)=O)(C(=O)OC)[H])/N5)[H])[H])\[H])/N4)O3)[H]
1 reference
stated in
ChEBI
ChEBI ID
90228
language of work or name
English
title
epoxypheophorbide a
(English)
retrieved
9 October 2016
Identifiers
InChI
InChI=1S/C35H36N4O6/c1-8-18-15(4)29-33-35(45-33)20(9-2)16(5)23(39-35)12-21-14(3)19(10-11-25(40)41)30(36-21)27-28(34(43)44-7)32(42)26-17(6)22(37-31(26)27)13-24(18)38-29/h9,12-14,19,28,33,37,39H,2,8,10-11H2,1,3-7H3,(H,40,41)/b23-12-,24-13-,30-27-/t14-,19-,28+,33?,35?/m0/s1
1 reference
stated in
ChEBI
ChEBI ID
90228
language of work or name
English
title
epoxypheophorbide a
(English)
retrieved
9 October 2016
InChIKey
ICQNLVYDPRIQAA-UJSYQKIMSA-N
2 references
stated in
ChEBI
ChEBI ID
90228
language of work or name
English
title
epoxypheophorbide a
(English)
retrieved
9 October 2016
stated in
ChEBI release 2020-09-01
ChEBI ID
90228
mapping relation type
exact match
1 reference
stated in
ChEBI
ChEBI ID
90228
language of work or name
English
title
epoxypheophorbide a
(English)
retrieved
9 October 2016
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