Torrubiellone A, (cis)- (Q27138626)

TORRUBIELLONE A (English)

7 October 2016

chemical formula

C₂₂H₂₉NO₇

0 references

canonical SMILES

CCC(C(=C(C(=C(C(=C(C(C1=C(C(=CN(C1=O)O)C2(CCC(CC2)(O)[H])O)O)=O)[H])[H])[H])[H])[H])[H])(CO)[H]

1 reference

Torrubiellone A, (cis)- (English)

7 October 2016

isomeric SMILES

CCC(\C(=C(\C(=C(\C(=C(\C(C1=C(C(=CN(C1=O)O)[C@]2(CC[C@@](CC2)(O)[H])O)O)=O)/[H])\[H])/[H])\[H])/[H])\[H])(CO)[H]

1 reference

Pyridone and tetramic acid alkaloids from the spider pathogenic fungus Torrubiella sp. BCC 2165.

Torrubiellone A, (cis)- (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C22H29NO7/c1-2-15(14-24)7-5-3-4-6-8-18(26)19-20(27)17(13-23(30)21(19)28)22(29)11-9-16(25)10-12-22/h3-8,13,15-16,24-25,27,29-30H,2,9-12,14H2,1H3/b4-3+,7-5+,8-6+/t15?,16-,22+

1 reference

Torrubiellone A, (cis)- (English)

WXLPIUFTKBWEGE-ZSBVLOQZSA-N

7 October 2016

InChIKey

2 references

Torrubiellone A, (cis)- (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

5-(cis-1,4-Dihydroxycyclohexyl)-1,4-dihydroxy-3-[(2E,4E,6E)-8-(hydroxymethyl)-2,4,6-decatrienoyl]-2(1H)-pyridinone (English)

7 October 2016

ChEBI ID

70286

mapping relation type

2 references

Torrubiellone A, (cis)- (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C22H29NO7/c1-2-15(14-24)7-5-3-4-6-8-18(26)19-20(27)17(13-23(30)21(19)28)22(29)11-9-16(25)10-12-22/h3-8,13,15-16,24-25,27,29-30H,2,9-12,14H2,1H3/b4-3+,7-5+,8-6+/t15?,16-,22+

1 reference

TORRUBIELLONE A (English)