(Q105306879)

English

(1R,2R,5R,7R,9S,10R,11S,14S)-10-(hydroxymethyl)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-16(24),17,19,21-tetraen-9-ol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

10-(Hydroxymethyl)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-16(24),17,19,21-tetraen-9-ol

1 reference

based on heuristic

inferred from SMILES

mass

453.287908728 dalton

1 reference

1 reference

C₂₈H₃₉NO₄

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canonical SMILES

OCC12C(O)CC(OC2CCC3(C)C1CCC4CC=5C=6C=CC=CC6NC5C43C)C(O)(C)C

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isomeric SMILES

CC(C)(O)[C@H]1C[C@H](O)[C@]2(CO)[C@H]3CC[C@H]4Cc5c([nH]c6ccccc56)[C@@]4(C)[C@]3(C)CC[C@H]2O1

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found in taxon

Albophoma yamanashiensis

1 reference

stated in

Terpendoles, novel ACAT inhibitors produced by Albophoma yamanashiensis. III. Production, isolation and structure elucidation of new components

Identifiers

InChI

InChI=1S/C28H39NO4/c1-25(2,32)23-14-21(31)28(15-30)20-10-9-16-13-18-17-7-5-6-8-19(17)29-24(18)27(16,4)26(20,3)12-11-22(28)33-23/h5-8,16,20-23,29-32H,9-15H2,1-4H3/t16-,20-,21-,22+,23+,26+,27-,28-/m0/s1

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InChIKey

WJKJBBVBVFTCQK-LZENEGHOSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105306879)

(1R,2R,5R,7R,9S,10R,11S,14S)-10-(hydroxymethyl)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-16(24),17,19,21-tetraen-9-ol

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Identifiers

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