Stereochemistry | ABSOLUTE |
Molecular Formula | C73H97ClN18O14 |
Molecular Weight | 1486.1192 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C(C=C1)C(=O)CC[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H](CC2=CC=C(Cl)C=C2)NC(=O)[C@@H](CC3=CC=CN=C3)NC(=O)[C@@H](CC4=CC=C5C=CC=CC5=C4)NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N6CCC[C@H]6C(=O)N[C@H](C)C(N)=O
InChI
InChIKey=CJYBENVAJFXMJX-YKJOSNDESA-N
InChI=1S/C73H97ClN18O14/c1-41(2)34-55(65(99)87-54(16-10-32-82-73(78)79)71(105)92-33-11-17-60(92)70(104)83-42(3)62(75)96)88-64(98)53(28-29-61(95)48-22-26-51(106-5)27-23-48)86-63(97)52(15-9-31-81-72(76)77)85-69(103)59(40-93)91-68(102)57(36-44-19-24-50(74)25-20-44)89-67(101)58(38-46-12-8-30-80-39-46)90-66(100)56(84-43(4)94)37-45-18-21-47-13-6-7-14-49(47)35-45/h6-8,12-14,18-27,30,35,39,41-42,52-60,93H,9-11,15-17,28-29,31-34,36-38,40H2,1-5H3,(H2,75,96)(H,83,104)(H,84,94)(H,85,103)(H,86,97)(H,87,99)(H,88,98)(H,89,101)(H,90,100)(H,91,102)(H4,76,77,81)(H4,78,79,82)/t42-,52+,53-,54+,55+,56-,57-,58-,59+,60+/m1/s1
Molecular Formula | C73H97ClN18O14 |
Molecular Weight | 1486.1192 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |