Stereochemistry | ABSOLUTE |
Molecular Formula | C76H131N17O19 |
Molecular Weight | 1586.9558 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 17 / 17 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCCCCCCCCCC(=O)N1CCC[C@H]1C(=O)N(C)[C@@H]([C@H](C)O)C(=O)NCC(=O)N[C@H](C(C)C)C(=O)N[C@H]([C@H](C)CC)C(=O)N[C@H](C)C(=O)N\C(=C/C)C(=O)N[C@@H]2[C@@H](C)OC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC2=O)C(C)C)C(C)C)[C@H](C)O)C(C)C)[C@@H]3CCN=C(NC)N3C
InChI
InChIKey=BSYZEPITIGFSDX-SNWSSYJASA-N
InChI=1S/C76H131N17O19/c1-20-23-24-25-26-27-28-29-30-33-53(98)93-36-31-32-51(93)74(110)92(19)62(46(15)96)73(109)79-37-52(97)83-54(39(4)5)66(102)87-58(43(12)21-2)70(106)80-44(13)63(99)81-48(22-3)64(100)89-60-47(16)112-75(111)61(50-34-35-78-76(77-17)91(50)18)90-69(105)55(40(6)7)84-65(101)49(38-94)82-71(107)59(45(14)95)88-68(104)57(42(10)11)85-67(103)56(41(8)9)86-72(60)108/h22,39-47,49-51,54-62,94-96H,20-21,23-38H2,1-19H3,(H,77,78)(H,79,109)(H,80,106)(H,81,99)(H,82,107)(H,83,97)(H,84,101)(H,85,103)(H,86,108)(H,87,102)(H,88,104)(H,89,100)(H,90,105)/b48-22-/t43-,44-,45+,46+,47-,49+,50+,51+,54-,55-,56-,57+,58-,59-,60-,61+,62+/m1/s1
Molecular Formula | C76H131N17O19 |
Molecular Weight | 1586.9558 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 17 / 17 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |