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Basic Information |
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Product Name: | TRIOSTIN C |
CAS: | 10382-35-1 |
English Synonyms: | TRIOSTIN C |
MDL Number.: | MFCD01677756 |
H bond acceptor: | 24 |
H bond donor: | 4 |
Smile: | C[C@H]1C(=O)N([C@H]2CSSC[C@@H](C(=O)N([C@H](C(=O)OC[C@H](C(=O)N1)NC(=O)c3cnc4ccccc4n3)C(C)C(C)C)C)N(C(=O)[C@@H](NC(=O)[C@@H](COC(=O)[C@@H](N(C2=O)C)C(C)C(C)C)NC(=O)c5cnc6ccccc6n5)C)C)C |
InChi: | InChI=1S/C54H70N12O12S2/c1-27(2)29(5)43-53(75)77-23-39(61-45(67)37-21-55-33-17-13-15-19-35(33)59-37)47(69)57-32(8)50(72)64(10)42-26-80-79-25-41(51(73)65(43)11)63(9)49(71)31(7)58-48(70)40(24-78-54(76)44(30(6)28(3)4)66(12)52(42)74)62-46(68)38-22-56-34-18-14-16-20-36(34)60-38/h13-22,27-32,39-44H,23-26H2,1-12H3,(H,57,69)(H,58,70)(H,61,67)(H,62,68)/t29?,30?,31-,32-,39+,40+,41-,42-,43-,44-/m0/s1 |
InChiKey: | InChIKey=AAKHBCYMJPWUTO-WZNZPUPOSA-N |
* If the product has intellectual property rights, a license granted is must or contact us.