Pseudoxylallemycin B (5XHJ290).hsqc
URL: https://nmrxiv.org/D124
Chemical Info
| InChI |
InChI=1S/C40H52N4O6/c1-9-11-21-49-31-17-13-29(14-18-31)25-33-39(47)43(7)36(24-28(5)6)38(46)42-34(26-30-15-19-32(20-16-30)50-22-12-10-2)40(48)44(8)35(23-27(3)4)37(45)41-33/h11-20,27-28,33-36H,1-2,21-26H2,3-8H3,(H,41,45)(H,42,46) |
| SMILES |
C=C=CCOC1=CC=C(CC2NC(=O)C(CC(C)C)N(C)C(=O)C(CC3=CC=C(OCC=C=C)C=C3)NC(=O)C(CC(C)C)N(C)C2=O)C=C1 |
| InChI Key |
QWMKZQLCKVCIIN-UHFFFAOYSA-N |
| Molecular Formula |
C40H52N4O6 |
| Exact Mass |
684.900 g/mol |
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