Stereochemistry | ABSOLUTE |
Molecular Formula | C61H81N15O13 |
Molecular Weight | 1232.3885 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)C[C@H](NC(=O)[C@@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@H](CO)NC(=O)[C@@H]4CCCN4C(=O)[C@@H](CC5=CC=CC=C5)NC(=O)[C@@H]6CCC(=O)N6)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N7CCC[C@H]7C(=O)NCC(N)=O
InChI
InChIKey=LBHZACMDURCPMK-DIPDENTNSA-N
InChI=1S/C61H81N15O13/c1-34(2)27-43(53(82)69-42(15-8-24-65-61(63)64)59(88)75-25-9-16-48(75)57(86)67-32-50(62)79)70-55(84)45(30-37-31-66-40-14-7-6-13-39(37)40)72-54(83)44(28-36-18-20-38(78)21-19-36)71-56(85)47(33-77)74-58(87)49-17-10-26-76(49)60(89)46(29-35-11-4-3-5-12-35)73-52(81)41-22-23-51(80)68-41/h3-7,11-14,18-21,31,34,41-49,66,77-78H,8-10,15-17,22-30,32-33H2,1-2H3,(H2,62,79)(H,67,86)(H,68,80)(H,69,82)(H,70,84)(H,71,85)(H,72,83)(H,73,81)(H,74,87)(H4,63,64,65)/t41-,42-,43-,44-,45+,46+,47-,48-,49-/m0/s1
Molecular Formula | C61H81N15O13 |
Molecular Weight | 1232.3885 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |