Try beta.chemspider
- Charge
- Double-bond stereo
- 16 of 17 defined stereocentres
CC1(C)[C@H](CCC(N)=O)[C@H]2C(C)=C3N4[C@H]([C@H](CC(N)=O)[C@@]3(C)CCC(=O)NC[C@@H](C)OP(O)(=O)O[C@@H]3[C@@H](CO)O[C@@H]([C@@H]3O)N3C=NC5C=C(C)C(C)=CC3=5)[C@]3(C)N5C([C@@H](CCC(N)=O)[C@]3(C)CC(N)=O)C(C)=C3N6[C@H](C=C1N2[Co]654)[C@@H](CCC(N)=O)[C@]3(C)CC(N)=O
InChI=1S/C62H92N13O14P.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;/h20-21,23,28,31,34-38,41,50-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H2,63,77)(H2,64,78)(H2,65,79)(H2,66,80)(H2,67,81)(H2,68,82)(H,69,83)(H,85,86);/q-4;+4/b42-23-,54-32-,55-33-;/t31-,34-,35-,36-,37+,38-,41-,50-,51?,52-,53-,56-,57+,59-,60+,61+,62+;/m1./s1
WEDFGJZTRYQXID-QPVGOBPLSA-N
CSID:61712478, http://www.chemspider.com/Chemical-Structure.61712478.html (accessed 10:37, Jun 10, 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
Advertisement
Spotlight