(Q104973722)

English

methyl (1R,14S,19R,21S)-21-hydroxy-19-methyl-20-oxa-5,15-diazahexacyclo[12.4.2.1¹,¹².0⁴,¹².0⁶,¹¹.0¹⁵,²¹]henicosa-3,6,8,10,17-pentaene-3-carboxylate

group of stereoisomers with the chemical formula C₂₁H₂₂N₂O₄

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No description defined

Statements

group of stereoisomers

0 references

aspidospermine / aspidofractine / kopsane alkaloid

1 reference

aspidospermine / aspidofractine / kopsane alkaloid

366.157957184 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₁H₂₂N₂O₄

0 references

canonical SMILES

O=C(OC)C1=C2NC=3C=CC=CC3C24CC5OC(C)C6(C=CCN5C64O)C1

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isomeric SMILES

COC(=O)C1=C2Nc3ccccc3C23C[C@@H]2O[C@H](C)[C@]4(C=CCN2[C@]34O)C1

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Identifiers

InChI=1S/C21H22N2O4/c1-12-19-8-5-9-23-16(27-12)11-20(21(19,23)25)14-6-3-4-7-15(14)22-17(20)13(10-19)18(24)26-2/h3-8,12,16,22,25H,9-11H2,1-2H3/t12-,16+,19+,20?,21-/m1/s1

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DANNLLVHDDUBFO-XDOTZXDNSA-N

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2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DANNLLVHDDUBFO-XDOTZXDNSA-N

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