Inchi | InChI=1S/C50H72N14O11/c1-5-28(4)41(47(72)60-36(23-31-25-55-26-57-31)48(73)64-20-10-14-38(64)45(70)61-37(49(74)75)22-29-11-7-6-8-12-29)63-44(69)35(21-30-15-17-32(65)18-16-30)59-46(71)40(27(2)3)62-43(68)34(13-9-19-56-50(53)54)58-42(67)33(51)24-39(52)66/h6-8,11-12,15-18,25-28,33-38,40-41,65H,5,9-10,13-14,19-24,51H2,1-4H3,(H2,52,66)(H,55,57)(H,58,67)(H,59,71)(H,60,72)(H,61,70)(H,62,68)(H,63,69)(H,74,75)(H4,53,54,56)/t28-,33-,34-,35-,36-,37-,38-,40-,41-/m0/s1 |
InChIKey | MPKNWWOXPCCKSV-JZXHSEFVSA-N |
SMILES | N/C(=N/CCC[C@@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N1CCC[C@H]1C(N[C@@H](CC1C=CC=CC=1)C(=O)O)=O)=O)CC1=CN=CN1)=O)[C@H](CC)C)=O)CC1C=CC(O)=CC=1)=O)C(C)C)=O)NC([C@H](CC(=O)N)N)=O)/N |
精确分子量 | 1295.68000 |
PSA | 493.22000 |
LogP | 3.83280 |
EINECS | 215-804-9 |