(Q75055152)

English

Asterriquinone CT2

bioactive natural product

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Statements

instance of

type of chemical entity

0 references

subclass of

indole alkaloid

0 references

mass

504.204907376 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₂H₂₈N₂O₄

0 references

canonical SMILES

O=C1C(O)=C(C(=O)C(O)=C1C2=CNC=3C=C(C=CC(=C)C)C=CC32)C4=CNC=5C=C(C=CC54)CC=C(C)C

0 references

isomeric SMILES

C=C(C)/C=C/c1ccc2c(C3=C(O)C(=O)C(c4c[nH]c5cc(CC=C(C)C)ccc45)=C(O)C3=O)c[nH]c2c1

1 reference

2 references

Isolation and structure elucidation of five new asterriquinones from Aspergillus, Humicola and Botryotrichum species

stated in

Isolation and structure elucidation of five new asterriquinones from Aspergillus, Humicola and Botryotrichum species

Identifiers

InChI

InChI=1S/C32H28N2O4/c1-17(2)5-7-19-9-11-21-23(15-33-25(21)13-19)27-29(35)31(37)28(32(38)30(27)36)24-16-34-26-14-20(8-6-18(3)4)10-12-22(24)26/h5-7,9-16,33-35,38H,1,8H2,2-4H3/b7-5+

0 references

InChIKey

XUNIIULIATZTPL-FNORWQNLSA-N

0 references

2 references

language of work or name

English

matched by identifier from

InChIKey

XUNIIULIATZTPL-FNORWQNLSA-N

ChEBI ID

197780

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C32H28N2O4/c1-17(2)5-7-19-9-11-21-23(15-33-25(21)13-19)27-29(35)31(37)28(32(38)30(27)36)24-16-34-26-14-20(8-6-18(3)4)10-12-22(24)26/h5-7,9-16,33-35,38H,1,8H2,2-4H3/b7-5+

1 reference

Natural Product Atlas ID

NPA000277

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

XUNIIULIATZTPL-FNORWQNLSA-N

(Q75055152)

Asterriquinone CT2

Statements

Identifiers

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