Basic Information |
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Product Name: | CRGDSPASSC, CYCLIC |
English Synonyms: | FR-1 ; CRGDSPASSC, CYCLIC |
MDL Number.: | MFCD00797881 |
H bond acceptor: | 29 |
H bond donor: | 17 |
Smile: | C[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N1)CO)CC(=O)O)CCCNC(=N)N)N)C(=O)O)CO)CO |
InChi: | InChI=1S/C35H57N13O16S2/c1-15-26(55)44-19(10-49)30(59)45-20(11-50)31(60)47-22(34(63)64)14-66-65-13-16(36)27(56)43-17(4-2-6-39-35(37)38)28(57)40-9-24(52)42-18(8-25(53)54)29(58)46-21(12-51)33(62)48-7-3-5-23(48)32(61)41-15/h15-23,49-51H,2-14,36H2,1H3,(H,40,57)(H,41,61)(H,42,52)(H,43,56)(H,44,55)(H,45,59)(H,46,58)(H,47,60)(H,53,54)(H,63,64)(H4,37,38,39)/t15-,16-,17-,18-,19-,20-,21-,22-,23-/m0/s1 |
InChiKey: | InChIKey=OXKXVXZQISLSJA-NQBGTIOHSA-N |
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