Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C81H123N27O22 |
| Molecular Weight | 1827.011 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 16 / 16 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC2=CNC=N2)NC(=O)[C@@H](NC(=O)[C@H](CC3=CNC=N3)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC4=CC=C(O)C=C4)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(O)=O)C(O)=O
InChI
InChIKey=BVYCLXHMAPEQLA-YNWLHDTASA-N
InChI=1S/C81H123N27O22/c1-8-41(5)64(76(126)99-52(24-26-59(84)112)70(120)104-57(79(129)130)33-62(115)116)106-61(114)37-93-68(118)50(17-13-27-91-80(85)86)97-73(123)54(29-44-15-11-10-12-16-44)101-75(125)63(40(3)4)105-60(113)36-94-69(119)55(31-46-34-89-38-95-46)102-78(128)66(43(7)109)108-74(124)56(32-47-35-90-39-96-47)103-77(127)65(42(6)9-2)107-71(121)51(18-14-28-92-81(87)88)98-72(122)53(30-45-19-21-48(110)22-20-45)100-67(117)49(82)23-25-58(83)111/h10-12,15-16,19-22,34-35,38-43,49-57,63-66,109-110H,8-9,13-14,17-18,23-33,36-37,82H2,1-7H3,(H2,83,111)(H2,84,112)(H,89,95)(H,90,96)(H,93,118)(H,94,119)(H,97,123)(H,98,122)(H,99,126)(H,100,117)(H,101,125)(H,102,128)(H,103,127)(H,104,120)(H,105,113)(H,106,114)(H,107,121)(H,108,124)(H,115,116)(H,129,130)(H4,85,86,91)(H4,87,88,92)/t41-,42-,43+,49-,50-,51-,52-,53-,54-,55-,56-,57-,63-,64-,65-,66-/m0/s1
| Molecular Formula | C81H123N27O22 |
| Molecular Weight | 1827.011 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 16 / 16 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 10:20:56 GMT 2025
by
admin
on
Wed Apr 02 10:20:56 GMT 2025
|
| Record UNII |
YD3MM6SP3C
|
| Record Status |
alternative
|
| Record Version |
|
-
Download
| Related Record | Type | Details | ||
|---|---|---|---|---|
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Primary Definition |