Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C28H26N4O7S |
Molecular Weight | 562.594 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CNC(=O)C1=CC=CC=C1SC2=CC3=C(C=C2)C(\C=C\C4=CC=CC=N4)=NN3[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O
InChI
InChIKey=YYKQABKSJYLETI-GCBNXPIGSA-N
InChI=1S/C28H26N4O7S/c1-29-26(36)18-7-2-3-8-21(18)40-16-10-11-17-19(12-9-15-6-4-5-13-30-15)31-32(20(17)14-16)27-24(35)22(33)23(34)25(39-27)28(37)38/h2-14,22-25,27,33-35H,1H3,(H,29,36)(H,37,38)/b12-9+/t22-,23-,24+,25-,27+/m0/s1
Approval Year
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I7W61FSA1A
Created by
admin on Sat Dec 16 09:16:38 GMT 2023 , Edited by admin on Sat Dec 16 09:16:38 GMT 2023
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91827015
Created by
admin on Sat Dec 16 09:16:38 GMT 2023 , Edited by admin on Sat Dec 16 09:16:38 GMT 2023
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PRIMARY |
PARENT (METABOLITE INACTIVE)
SUBSTANCE RECORD