Try beta.chemspider
- Charge
- Double-bond stereo
- 2 of 4 defined stereocentres
{3,3',3'',3'''-[(8S,11S,12S,13S)-3,8,13,17-Tetrakis(carboxymethyl)-8,13-dimethyl-8,11,12,13,22,24-hexahydroporphyrin-2,7,12,18-tetrayl-kappa~4~N~21~,N~22~,N~23~,N~24~]tetrapropanoato(4-)}iron
C[C@@]1(CC(O)=O)C2=C[C@@H]3[C@@H](CCC(O)=O)[C@](C)(CC(O)=O)C4=CC5=C(CC(O)=O)C(CCC(O)=O)=C6C=C7C(CCC(O)=O)=C(CC(O)=O)C8=CC(=C1CCC(O)=O)N2[Fe](N43)(N65)N78
InChI=1S/C42H44N4O16.Fe/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;/h13-16,24,30H,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);/q-4;+4/b25-13-,27-14-,31-15-,32-16-;/t24?,30-,41+,42?;/m1./s1
CDIXXIOGUDZTOM-AYECVSSUSA-N
CSID:79716151, http://www.chemspider.com/Chemical-Structure.79716151.html (accessed 12:57, May 15, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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