(Q105006578)

English

(3aS,6S)-3a-(6-{[(1S,12S,14S)-14-hydroxy-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.0¹,¹².0⁶,¹⁷]heptadeca-6,8,10(17)-trien-4-yl]methyl}-2H-1,3-benzodioxol-5-yl)-6-methoxy-1-methyl-2,6,7,7a-tetrahydroindol-3-one

group of stereoisomers with the chemical formula C₃₄H₄₀N₂O₇

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instance of

group of stereoisomers

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1 reference

588.2835516199999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₃₄H₄₀N₂O₇

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canonical SMILES

O=C1CN(C)C2CC(OC)C=CC12C3=CC=4OCOC4C=C3CN5CC6=CC=C(OC)C=7OC8CC(O)CCC8(C76)CC5

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isomeric SMILES

COc1ccc2c3c1O[C@H]1C[C@@H](O)CC[C@]31CCN(Cc1cc3c(cc1[C@@]14C=C[C@@H](OC)CC1N(C)CC4=O)OCO3)C2

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Identifiers

InChI

InChI=1S/C34H40N2O7/c1-35-18-29(38)34(9-7-23(39-2)14-28(34)35)24-15-27-26(41-19-42-27)12-21(24)17-36-11-10-33-8-6-22(37)13-30(33)43-32-25(40-3)5-4-20(16-36)31(32)33/h4-5,7,9,12,15,22-23,28,30,37H,6,8,10-11,13-14,16-19H2,1-3H3/t22-,23+,28?,30-,33+,34-/m0/s1

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InChIKey

GCZMAMNLUPNIJZ-GLZCSZHCSA-N

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PubChem CID

14707484

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

GCZMAMNLUPNIJZ-GLZCSZHCSA-N

1 reference

(Q105006578)

(3aS,6S)-3a-(6-{[(1S,12S,14S)-14-hydroxy-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.0¹,¹².0⁶,¹⁷]heptadeca-6,8,10(17)-trien-4-yl]methyl}-2H-1,3-benzodioxol-5-yl)-6-methoxy-1-methyl-2,6,7,7a-tetrahydroindol-3-one

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