(Q105274964)

English

(1R,5E,7R,9S,11E,13S,14S,17S,18S)-7,14-dihydroxy-18-[(4-methoxyphenyl)methyl]-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

chemical compound

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instance of

type of chemical entity

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subclass of

7,14-Dihydroxy-18-[(4-methoxyphenyl)methyl]-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

1 reference

based on heuristic

inferred from SMILES

mass

525.23626708 dalton

1 reference

1 reference

inferred from InChIKey

chemical formula

C₂₉H₃₅NO₈

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canonical SMILES

COc1ccc(CC2NC(=O)C34OC(=O)OC=CC(C)(O)C(=O)C(C)CC=CC3C(O)C(C)=C(C)C24)cc1

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isomeric SMILES

COc1ccc(C[C@@H]2NC(=O)[C@]34OC(=O)O/C=C/[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]3[C@H](O)C(C)=C(C)[C@@H]24)cc1

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found in taxon

Peroneutypa scoparia

1 reference

stated in

Pimarane Diterpene and Cytochalasin Derivatives from the Endophytic FungusEutypellascopariaPSU-D44

Identifiers

InChI

InChI=1S/C29H35NO8/c1-16-7-6-8-21-24(31)18(3)17(2)23-22(15-19-9-11-20(36-5)12-10-19)30-26(33)29(21,23)38-27(34)37-14-13-28(4,35)25(16)32/h6,8-14,16,21-24,31,35H,7,15H2,1-5H3,(H,30,33)/b8-6+,14-13+/t16-,21-,22-,23-,24+,28+,29-/m0/s1

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InChIKey

UKXQRSOMKIGRCJ-WSUHWBCWSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105274964)

(1R,5E,7R,9S,11E,13S,14S,17S,18S)-7,14-dihydroxy-18-[(4-methoxyphenyl)methyl]-7,9,15,16-tetramethyl-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11,15-triene-3,8,20-trione

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