(Q105188908)

English

(1S,2R,5S,7S,8R,9R,11S,12R,14S,16R)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6,10,13-trioxa-25-azaoctacyclo[14.10.0.02,12.05,11.09,11.012,14.018,26.019,24]hexacosa-18(26),19,21,23-tetraen-8-ol

chemical compound

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instance of

type of chemical entity

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subclass of

7-(2-Hydroxypropan-2-yl)-1,2-dimethyl-6,10,13-trioxa-25-azaoctacyclo[14.10.0.02,12.05,11.09,11.012,14.018,26.019,24]hexacosa-18(26),19,21,23-tetraen-8-ol

1 reference

1 reference

451.235873156 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,2S,5S,7R,8R,9R,11S,12R,14S,16S)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6,10,13-trioxa-25-azaoctacyclo[14.10.0.02,12.05,11.09,11.012,14.018,26.019,24]hexacosa-18(26),19,21,23-tetraen-8-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₃NO₅

0 references

canonical SMILES

OC1C(OC2CCC3(C)C4(OC4CC5CC=6C=7C=CC=CC7NC6C53C)C82OC18)C(O)(C)C

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isomeric SMILES

CC(C)(O)[C@H]1O[C@H]2CC[C@]3(C)[C@@]4(C)c5[nH]c6ccccc6c5C[C@@H]4C[C@@H]4O[C@@]43[C@]23O[C@@H]3[C@@H]1O

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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/C27H33NO5/c1-23(2,30)21-19(29)22-26(33-22)17(31-21)9-10-24(3)25(4)13(12-18-27(24,26)32-18)11-15-14-7-5-6-8-16(14)28-20(15)25/h5-8,13,17-19,21-22,28-30H,9-12H2,1-4H3/t13-,17+,18+,19-,21+,22-,24-,25-,26+,27+/m1/s1

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InChIKey

OAZQOSOFFNLFEK-RQPFSYJDSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

OAZQOSOFFNLFEK-RQPFSYJDSA-N

1 reference

(Q105188908)

(1S,2R,5S,7S,8R,9R,11S,12R,14S,16R)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6,10,13-trioxa-25-azaoctacyclo[14.10.0.02,12.05,11.09,11.012,14.018,26.019,24]hexacosa-18(26),19,21,23-tetraen-8-ol

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