Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C45H63N3O12 |
| Molecular Weight | 837.9946 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CO[C@H]1\C=C\O[C@@]2(C)OC3=C(C2=O)C4=C(O)C(N5CCN(CC(C)C)CC5)=C(NC(=O)C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)C(O)=C4C(O)=C3C
InChI
InChIKey=XUBKCCSAVNRWOX-BVHPQESASA-N
InChI=1S/C45H63N3O12/c1-22(2)21-47-16-18-48(19-17-47)35-34-39(53)32-31(40(35)54)33-42(28(8)38(32)52)60-45(10,43(33)55)58-20-15-30(57-11)25(5)41(59-29(9)49)27(7)37(51)26(6)36(50)23(3)13-12-14-24(4)44(56)46-34/h12-15,20,22-23,25-27,30,36-37,41,50-54H,16-19,21H2,1-11H3,(H,46,56)/b13-12+,20-15+,24-14-/t23-,25+,26+,27+,30-,36-,37+,41+,45-/m0/s1
| Molecular Formula | C45H63N3O12 |
| Molecular Weight | 837.9946 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:29:42 GMT 2023
by
admin
on
Sat Dec 16 19:29:42 GMT 2023
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| Record UNII |
5ARN4FK9X2
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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5ARN4FK9X2
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57184-22-2
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6438469
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admin on Sat Dec 16 19:29:43 GMT 2023 , Edited by admin on Sat Dec 16 19:29:43 GMT 2023
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