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Sirohydrochlorin
MNXM863 is deprecated and here replaced by MNXM740870
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM740870 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 2 |
| in models (compartimentalized) |
2 |
|
| formula | C42H39N4O16 |
| charge | -7 |
| mass | 855.23995 |
| reference | biggM:srch |
| InChIKey | KWIZRXMMFRBUML-SSNFXWCSSA-G |
| InChI | InChI=1S/C42H46N4O16/c1-41(17-39(59)60)23(5-9-35(51)52)29-14-27-21(11-37(55)56)19(3-7-33(47)48)25(43-27)13-26-20(4-8-34(49)50)22(12-38(57)58)28(44-26)15-31-42(2,18-40(61)62)24(6-10-36(53)54)30(46-31)16-32(41)45-29/h13-16,23-24,44-45H,3-12,17-18H2,1-2H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)/p-7/b25-13?,29-14-,31-15-,32-16- |
| SMILES | CC1(CC(=O)[O-])/C2=C/c3[nH]c(c(CCC(=O)[O-])c3CC(=O)[O-])C=C3N=C(/C=C4\[NH2+]/C(=C\C(=N2)C1CCC(=O)[O-])C(C)(CC(=O)[O-])C4CCC(=O)[O-])C(CC(=O)[O-])=C3CCC(=O)[O-] |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
bigg.metabolite:srch
biggM:srch
| Sirohydrochlorin
|
| biggM:M_srch
| secondary/obsolete/fantasy identifier
|
