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Precorrin 2

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1373210 Image of MNXM1373210 Image of MNXM1373210
#reac
in my sandbox 0
in MNXref (generic)11
in models (compartimentalized) 3
formulaC42H40N4O16
charge-8
mass856.794
referenceseedM:cpd01620
InChIKeyMFZGAVZCDXXITC-MMLYINKNSA-F
InChIInChI=1S/C42H48N4O16/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/h14,16,23-24,43-44H,3-13,15,17-18H2,1-2H3,(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-8/b29-14-,30-16?/t23-,24-,41+,42+/m1/s1
SMILESC[C@@]1(CC(=O)[O-])C2=NC(=CC3=N/C(=C\C4=C(CC(=O)[O-])C(CCC(=O)[O-])=C(CC5=C(CCC(=O)[O-])C(CC(=O)[O-])=C(C2)N5)N4)[C@@H](CCC(=O)[O-])[C@]3(C)CC(=O)[O-])[C@H]1CCC(=O)[O-]
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd01620
seedM:cpd01620
Precorrin 2
Dihydrosirohydrochlorin
dihydrosirohydrochlorin
pre2
precorrin-2
seedM:M_cpd01620 secondary/obsolete/fantasy identifier