**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

precorrin-3A

Properties Image with InChI numbering Occurences in reactions MNX_ID MNXM1369781 #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 1 formula C43H43N4O16 charge -7 mass 871.829 reference chebi:58561 InChIKey AILJETHLKULYHE-IHDLTXBCSA-G InChI InChI=1S/C43H50N4O16/c1-19-40-23(13-37(58)59)21(5-9-33(50)51)27(46-40)14-26-20(4-8-32(48)49)22(12-36(56)57)28(44-26)15-29-24(6-10-34(52)53)42(2,17-38(60)61)31(45-29)16-30-25(7-11-35(54)55)43(3,18-39(62)63)41(19)47-30/h15-16,24-25,44,46-47H,4-14,17-18H2,1-3H3,(H,48,49)(H,50,51)(H,52,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61)(H,62,63)/p-7/b29-15-,30-16-,41-19-/t24-,25-,42+,43+/m1/s1 SMILES [CH3:1]/[C:19]1=[C:41]2\[C@@:43]([CH3:3])([CH2:18][C:39](=[O:62])[OH:63])[C@H:25]([CH2:7][CH2:11][C:35](=[O:54])[OH:55])/[C:30](=[CH:16]/[C:31]3=[N:45]/[C:29](=[CH:15]\[c:28]4[c:22]([CH2:12][C:36](=[O:56])[OH:57])[c:20]([CH2:4][CH2:8][C:32](=[O:48])[OH:49])[c:26]([nH:44]4)[CH2:14][c:27]4[c:21]([CH2:5][CH2:9][C:33](=[O:50])[OH:51])[c:23]([CH2:13][C:37](=[O:58])[OH:59])[c:40]1[nH:46]4)[C@@H:24]([CH2:6][CH2:10][C:34](=[O:52])[OH:53])[C@:42]3([CH3:2])[CH2:17][C:38](=[O:60])[OH:61])[NH:47]2

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:58561 chebi:58561	precorrin-3A precorrin-3A(7-)
vmhM:pre3a vmhM:pre3a vmhmetabolite:pre3a vmhmetabolite:pre3a	Precorrin 3 A
kegg.compound:C05772 keggC:C05772	Precorrin 3A
metacyc.compound:CPD-642 metacycM:CPD-642	precorrin-3A
CHEBI:28307 chebi:28307	precorrin-3A 3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxymethyl)-8,13,15-trimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoic acid Precorrin 3A
chebi:14871 chebi:26221 chebi:8371 keggC:M_C05772	secondary/obsolete/fantasy identifier