Try beta.chemspider
- Charge
- 13 of 13 defined stereocentres
hydroxy-[(1R,2S,3S,4Z,7S,8S,9E,13S,14Z,17R,18R,19R)-2,7,18-tris(2-amino-2-oxo-ethyl)-3,8,13-tris(3-amino-3-oxo-propyl)-17-[3-[3-[[(2R,3R,4R,5R)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-oxido-phosphoryl]oxypropylamino]-3-oxo-propyl]-1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-21-yl]cobalt(1+)
Cc1cc2c(cc1C)n(cn2)[C@H]3[C@@H]([C@H]([C@H](O3)CO)OP(=O)([O-])OCCCNC(=O)CC[C@@]4([C@H]([C@@H]5[C@]6([C@@]([C@@H](/C(=C(/C7=N/C(=C/C8=N/C(=C(\C4=N5)/C)/[C@H](C8(C)C)CCC(=O)N)/[C@H]([C@]7(C)CC(=O)N)CCC(=O)N)\C)/N6[Co+]O)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O
InChI=1S/C62H90N13O14P.Co.H2O/c1-30-22-39-40(23-31(30)2)75(29-70-39)57-52(84)53(41(28-76)88-57)89-90(85,86)87-21-11-20-69-49(83)18-19-59(7)37(24-46(66)80)56-62(10)61(9,27-48(68)82)36(14-17-45(65)79)51(74-62)33(4)55-60(8,26-47(67)81)34(12-15-43(63)77)38(71-55)25-42-58(5,6)35(13-16-44(64)78)50(72-42)32(3)54(59)73-56;;/h22-23,25,29,34-37,41,52-53,56-57,76,84H,11-21,24,26-28H2,1-10H3,(H15,63,64,65,66,67,68,69,71,72,73,74,77,78,79,80,81,82,83,85,86);;1H2/q;+3;/p-3/t34-,35-,36-,37+,41-,52-,53+,56-,57-,59-,60+,61+,62+;;/m1../s1
ABSUWDOKDIWFOD-OVFPPADASA-K
CSID:67026935, http://www.chemspider.com/Chemical-Structure.67026935.html (accessed 07:47, Jul 27, 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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