(Q104993962)

English

3-[[2-[(3E,5E)-2,8-dihydroxy-7-methyldeca-3,5-dienyl]-1,6,8-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-hydroxymethylidene]-5-methoxypyrrolidine-2,4-dione

group of stereoisomers with the chemical formula C₃₀H₄₅NO₆

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Statements

instance of

group of stereoisomers

0 references

1 reference

515.32468816 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₄₅NO₆

0 references

canonical SMILES

CCC(O)C(C)C=CC=CC(O)CC1C=CC2CC(C)CC(C)C2C1(C)C(O)=C1C(=O)NC(OC)C1=O

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isomeric SMILES

CCC(O)C(C)/C=C/C=C/C(O)CC1C=CC2CC(C)CC(C)C2C1(C)C(O)=C1C(=O)NC(OC)C1=O

1 reference

2 references

Delaminomycins, novel extracellular matrix receptor antagonist. III. Physico-chemical properties and structure elucidation of delaminomycins B and C

stated in

Delaminomycins, novel nonpeptide extracellular matrix receptor antagonist and a new class of potent immunomodulator. I. Taxonomy, fermentation, isolation and biological activity.

Identifiers

InChI

InChI=1S/C30H45NO6/c1-7-23(33)18(3)10-8-9-11-22(32)16-21-13-12-20-15-17(2)14-19(4)25(20)30(21,5)27(35)24-26(34)29(37-6)31-28(24)36/h8-13,17-23,25,29,32-33,35H,7,14-16H2,1-6H3,(H,31,36)/b10-8+,11-9+,27-24?

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InChIKey

FEGZBWWSFAYQDU-JHQKYWRISA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FEGZBWWSFAYQDU-JHQKYWRISA-N

ChEBI ID

208796

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C30H45NO6/c1-7-23(33)18(3)10-8-9-11-22(32)16-21-13-12-20-15-17(2)14-19(4)25(20)30(21,5)27(35)24-26(34)29(37-6)31-28(24)36/h8-13,17-23,25,29,32-33,35H,7,14-16H2,1-6H3,(H,31,36)/b10-8+,11-9+,27-24?

1 reference

Natural Product Atlas ID

NPA018249

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FEGZBWWSFAYQDU-JHQKYWRISA-N

(Q104993962)

3-[[2-[(3E,5E)-2,8-dihydroxy-7-methyldeca-3,5-dienyl]-1,6,8-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-hydroxymethylidene]-5-methoxypyrrolidine-2,4-dione

Statements

Identifiers

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