phomalevone A (Q27136794)

PHOMALEVONE A (English)

7 October 2016

chemical formula

C₃₀H₂₆O₁₀

0 references

canonical SMILES

CC1=CC2=C(C(=C1C=3C(C)=CC4=C(C3O)C(C5=C(C=CC(C5(C)O4)(O)[H])O)=O)O)C(C6=C(C=CC(C6(C)O2)(O)[H])O)=O

1 reference

phomalevone A (English)

7 October 2016

isomeric SMILES

CC1=CC2=C(C(=C1C=3C(C)=CC4=C(C3O)C(C5=C(C=C[C@@]([C@]5(C)O4)(O)[H])O)=O)O)C(C6=C(C=C[C@@]([C@]6(C)O2)(O)[H])O)=O

1 reference

Phomalevones A−C: Dimeric and Pseudodimeric Polyketides from a Fungicolous Hawaiian Isolate ofPhomasp. (Cucurbitariaceae)

phomalevone A (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C30H26O10/c1-11-9-15-21(27(37)23-13(31)5-7-17(33)29(23,3)39-15)25(35)19(11)20-12(2)10-16-22(26(20)36)28(38)24-14(32)6-8-18(34)30(24,4)40-16/h5-10,17-18,31-36H,1-4H3/t17-,18-,29-,30-/m0/s1

1 reference

phomalevone A (English)

KMDRWTGFZLUZEY-NEUGYGHLSA-N

7 October 2016

InChIKey

2 references

phomalevone A (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(5S,5'S,10aR,10a'R)-1,1',5,5',8,8'-Hexahydroxy-3,3',10a,10a'-tetramethyl-5,5',10a,10a'-tetrahydro-9H,9'H-2,2'-bixanthene-9,9'-dione (English)

7 October 2016

Reaxys registry number

21389531

1 reference

phomalevone A (English)

7 October 2016

ChEBI ID

68297

mapping relation type

2 references

phomalevone A (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C30H26O10/c1-11-9-15-21(27(37)23-13(31)5-7-17(33)29(23,3)39-15)25(35)19(11)20-12(2)10-16-22(26(20)36)28(38)24-14(32)6-8-18(34)30(24,4)40-16/h5-10,17-18,31-36H,1-4H3/t17-,18-,29-,30-/m0/s1

1 reference

PHOMALEVONE A (English)