Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C57H97N3O17 |
Molecular Weight | 1096.39 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12C[C@@H](O)[C@H](O)[C@@](O)(C[C@H](O)[C@@H](C)CC[C@@H](O)[C@H](C)[C@@H](O)C[C@H](O)[C@@H](C)\C=C\C=C(C)\C(=O)O[C@@H]([C@@H](C)CCC\C=C\CCCN=C(NC)NC)[C@H](C)\C=C\C=C(C)\[C@@H](O)C[C@H](O)C[C@@H](O)C[C@@H](C1)OC(=O)CC(O)=O)O2
InChI
InChIKey=SPNDCJQGKUZBHK-HQKIQJKYSA-N
InChI=1S/C57H97N3O17/c1-34-19-16-21-38(5)53(37(4)18-14-12-10-11-13-15-25-60-56(58-8)59-9)76-55(73)39(6)22-17-20-35(2)47(65)31-48(66)40(7)45(63)24-23-36(3)50(68)33-57(74)54(72)49(67)30-44(77-57)29-43(75-52(71)32-51(69)70)27-41(61)26-42(62)28-46(34)64/h10-11,16-17,19-22,35-38,40-50,53-54,61-68,72,74H,12-15,18,23-33H2,1-9H3,(H,69,70)(H2,58,59,60)/b11-10+,20-17+,21-16+,34-19+,39-22+/t35-,36-,37-,38+,40-,41+,42+,43-,44-,45+,46-,47-,48-,49+,50-,53-,54-,57+/m0/s1
Molecular Formula | C57H97N3O17 |
Molecular Weight | 1096.39 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 18 / 18 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:00:07 GMT 2023
by
admin
on
Sat Dec 16 10:00:07 GMT 2023
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Record UNII |
H7Q3DUM9N6
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Record Status |
Validated (UNII)
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Record Version |
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73425500
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85113-99-1
Created by
admin on Sat Dec 16 10:00:07 GMT 2023 , Edited by admin on Sat Dec 16 10:00:07 GMT 2023
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