(Q27135194)

CHEBI:66579 (English)

7 October 2016

chemical formula

C₃₉H₅₇N₃O₆S₇

1 reference

CHEBI:66579 (English)

7 October 2016

canonical SMILES

CN(C)CCC1=C2C(=C(C(=C1SC)OC)OC)SC3=C(C(=C(C(=C3SSC4=C(C(=C(C(=C4S2)OC)OC)SC)CCN(C)C)CCN(C)C)SC)OC)OC

1 reference

Lissoclibadins 4-7, polysulfur aromatic alkaloids from the Indonesian ascidian Lissoclinum cf. badium

CHEBI:66579 (English)

7 October 2016

2 references

stated in

Cytotoxicity of lissoclibadins and lissoclinotoxins, isolated from a tropical ascidian Lissoclinum cf. badium, against human solid-tumor-derived cell lines

Identifiers

InChI

InChI=1S/C39H57N3O6S7/c1-40(2)19-16-22-31(49-13)25(43-7)28(46-10)37-34(22)52-38-29(47-11)26(44-8)32(50-14)23(17-20-41(3)4)35(38)54-55-36-24(18-21-42(5)6)33(51-15)27(45-9)30(48-12)39(36)53-37/h16-21H2,1-15H3

1 reference

CHEBI:66579 (English)

SYYGQWWWVKVZAF-UHFFFAOYSA-N

7 October 2016

InChIKey

2 references

CHEBI:66579 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

lissoclibadin 1 (English)

7 October 2016

2 references

CHEBI:66579 (English)

matched by identifier from

7 October 2016

InChIKey

SYYGQWWWVKVZAF-UHFFFAOYSA-N

Reaxys registry number

9892027

1 reference

lissoclibadin 1 (English)

7 October 2016

ChEBI ID

66579

mapping relation type

2 references

lissoclibadin 1 (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C39H57N3O6S7/c1-40(2)19-16-22-31(49-13)25(43-7)28(46-10)37-34(22)52-38-29(47-11)26(44-8)32(50-14)23(17-20-41(3)4)35(38)54-55-36-24(18-21-42(5)6)33(51-15)27(45-9)30(48-12)39(36)53-37/h16-21H2,1-15H3

1 reference