Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C78H117N23O22S |
| Molecular Weight | 1760.969 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 16 / 16 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H](O)[C@H](NC(=O)[C@@H](N)CC1=CNC=N1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC4=CNC5=C4C=CC=C5)C(=O)N6CCC[C@H]6C(O)=O
InChI
InChIKey=OZTWYWGXNSWRLN-NJKPRJKFSA-N
InChI=1S/C78H117N23O22S/c1-41(104)62(98-64(109)47(81)33-45-35-84-40-88-45)73(118)87-36-60(106)89-49(19-8-10-26-79)67(112)99-63(42(2)105)74(119)96-56(38-103)69(114)91-51(24-25-61(107)108)66(111)92-52(20-9-11-27-80)75(120)100-29-13-22-58(100)72(117)93-53(31-43-15-4-3-5-16-43)68(113)95-55(37-102)70(115)97-57(39-124)71(116)90-50(21-12-28-85-78(82)83)65(110)94-54(76(121)101-30-14-23-59(101)77(122)123)32-44-34-86-48-18-7-6-17-46(44)48/h3-7,15-18,34-35,40-42,47,49-59,62-63,86,102-105,124H,8-14,19-33,36-39,79-81H2,1-2H3,(H,84,88)(H,87,118)(H,89,106)(H,90,116)(H,91,114)(H,92,111)(H,93,117)(H,94,110)(H,95,113)(H,96,119)(H,97,115)(H,98,109)(H,99,112)(H,107,108)(H,122,123)(H4,82,83,85)/t41-,42-,47+,49+,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,62+,63+/m1/s1
| Molecular Formula | C78H117N23O22S |
| Molecular Weight | 1760.969 |
| 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 13:21:05 GMT 2025
by
admin
on
Wed Apr 02 13:21:05 GMT 2025
|
| Record UNII |
4D3454LXP4
|
| Record Status |
alternative
|
| Record Version |
|
-
Download
| Related Record | Type | Details | ||
|---|---|---|---|---|
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Primary Definition |
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