Annotation Hits
N
Screening or library annotations
Compound
Aclacinomycin B
NSID
NS00219787
SMILES
O=C2c1cc8c(c(O)c1C(=O)c3c2cccc3O)[C@@H](O[C@@H]7O[C@@H](C)[C@@H](O[C@@H]4O[C@@H](C)[C@H]5O[C@@H]6O[C@H](C(=O)C[C@@H]6O[C@H]5C4)C)[C@@H](N(C)C)C7)C[C@](O)(CC)[C@@H]8C(=O)OC
InChI
InChI=1S/C42H51NO15/c1-8-42(50)16-28(32-21(34(42)40(49)51-7)12-22-33(37(32)48)36(47)31-20(35(22)46)10-9-11-24(31)44)56-29-13-23(43(5)6)38(18(3)52-29)57-30-15-26-39(19(4)53-30)58-41-27(55-26)14-25(45)17(2)54-41/h9-12,17-19,23,26-30,34,38-39,41,44,48,50H,8,13-16H2,1-7H3/t17-,18-,19-,23-,26-,27-,28-,29-,30-,34-,38+,39+,41-,42+/m0/s1
InChIKey
RQHZAASWYUEYCJ-NFJBMJLVSA-N
CAS Number
—
2D Structure
RDKit depiction
See compound in other scientific sites:
References
N
Literature / database references
Patents
N
Patent records mentioning this compound
Monoisotopic Mass
N
Placeholder value (update later)
Temporal stripes
Literature stripe
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3D Structure
Interactive 3D view based on an RDKit ETKDG conformer (auto-loaded).