(Q105185770)

English

4-[(E)-3-Formyl-2-butenyl]-5,7-bis(3-methyl-2-butenyl)-6,8-dihydroxy-12,12-dimethyl-4beta,4abeta,2beta-(epoxy[1,2,3]propanetriyl)-4,4a-dihydro-9H-xanthene-3,9(2H)-dione

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

4-[6,8-Dihydroxy-17,17-dimethyl-5,7-bis(3-methylbut-2-enyl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.1.02,11.02,15.04,9]octadeca-4,6,8,11-tetraen-15-yl]-2-methylbut-2-enal

1 reference

1 reference

546.261753556 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₃₈O₇

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canonical SMILES

O=CC(=CCC12OC(C)(C)C3CC(C=C4C(=O)C=5C(O)=C(C(O)=C(C5OC431)CC=C(C)C)CC=C(C)C)C2=O)C

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isomeric SMILES

CC(C)=CCc1c(O)c(CC=C(C)C)c2c(c1O)C(=O)C1=C[C@H]3C[C@@H]4C(C)(C)O[C@](C/C=C(\C)C=O)(C3=O)[C@]14O2

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found in taxon

Garcinia gaudichaudii

2 references

stated in

Cytotoxic caged tetraprenylated xanthonoids from Garcinia gaudichaudii (Guttiferae)

stated in

Novel cytotoxic polyprenylated xanthonoids from Garcinia gaudichaudii (Guttiferae)

Identifiers

InChI

InChI=1S/C33H38O7/c1-17(2)8-10-21-26(35)22(11-9-18(3)4)29-25(27(21)36)28(37)23-14-20-15-24-31(6,7)40-32(30(20)38,33(23,24)39-29)13-12-19(5)16-34/h8-9,12,14,16,20,24,35-36H,10-11,13,15H2,1-7H3/b19-12+/t20-,24+,32+,33-/m0/s1

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InChIKey

NTZQQDZXDGOJFE-AZMKMPFMSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NTZQQDZXDGOJFE-AZMKMPFMSA-N

1 reference

(Q105185770)

4-[(E)-3-Formyl-2-butenyl]-5,7-bis(3-methyl-2-butenyl)-6,8-dihydroxy-12,12-dimethyl-4beta,4abeta,2beta-(epoxy[1,2,3]propanetriyl)-4,4a-dihydro-9H-xanthene-3,9(2H)-dione

Statements

Identifiers

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