(Q27134148)

English

crambescidin 800

chemical compound

In more languages

Statements

type of chemical entity

0 references

triazaacenaphthylene alkaloid

0 references

0 references

800.613934±0 dalton

1 reference

language of work or name

CHEBI:65666 (English)

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₅H₈₀N₆O₆

1 reference

language of work or name

CHEBI:65666 (English)

7 October 2016

canonical SMILES

CCC1C=CCCC2(O1)CC3CCC4N3C(=NC5(C4C(=O)OCCCCCCCCCCCCCCCC(=O)N(CCCN)CC(CCN)O)CCCC(O5)C)N2

1 reference

language of work or name

CHEBI:65666 (English)

7 October 2016

isomeric SMILES

CC[C@H]1C=CCC[C@]2(O1)C[C@@H]3CC[C@H]4N3C(=N[C@]5([C@H]4C(=O)OCCCCCCCCCCCCCCCC(=O)N(CCCN)C[C@H](CCN)O)CCC[C@H](O5)C)N2

1 reference

language of work or name

CHEBI:65666 (English)

7 October 2016

Celerina heffernani

1 reference

Ptilomycalin A, crambescidin 800 and related new highly cytotoxic guanidine alkaloids from the starfishes Fromia monilis and Celerina heffernani

Fromia heffernani

1 reference

Ptilomycalin A, crambescidin 800 and related new highly cytotoxic guanidine alkaloids from the starfishes Fromia monilis and Celerina heffernani

1 reference

Ptilomycalin A, crambescidin 800 and related new highly cytotoxic guanidine alkaloids from the starfishes Fromia monilis and Celerina heffernani

1 reference

Novel Alkaloids from the Sponge Batzella sp.: Inhibitors of HIV gp120-Human CD4 Binding

1 reference

Crambescidin 826 and dehydrocrambine A: new polycyclic guanidine alkaloids from the marine sponge Monanchora sp. that inhibit HIV-1 fusion

2 references

Crambescidins: new antiviral and cytotoxic compounds from the sponge Crambe crambe

Polycyclic guanidine alkaloids from the marine sponge Crambe crambe and Ca++ channel blocker activity of crambescidin 816.

Monanchora arbuscula

2 references

Isolation of crambescidin 800 from Monanchora arbuscula (Porifera)

Novel polycyclic guanidine alkaloids from two marine sponges of the genus Monanchora

Identifiers

InChI=1S/C45H80N6O6/c1-3-38-22-16-17-27-44(57-38)33-36-24-25-39-41(45(28-19-21-35(2)56-45)49-43(48-44)51(36)39)42(54)55-32-18-14-12-10-8-6-4-5-7-9-11-13-15-23-40(53)50(31-20-29-46)34-37(52)26-30-47/h16,22,35-39,41,52H,3-15,17-21,23-34,46-47H2,1-2H3,(H,48,49)/t35-,36+,37+,38+,39-,41-,44+,45-/m1/s1

1 reference

language of work or name

CHEBI:65666 (English)

7 October 2016

PPZWAJHYVRKUKB-BPXWMNIUSA-N

2 references

language of work or name

CHEBI:65666 (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

16-{[(2S)-4-Amino-2-hydroxybutyl](3-aminopropyl)amino}-16-oxohexadecyl (2S,2a'R,3'S,4'R,6''R,7S,8a'S)-7-ethyl-6''-methyl-1',2',2a',3',3'',4,4'',5'',6'',7,8',8a'-dodecahydro-3H,5'H-dispiro[oxepine-2,7' (English)

7 October 2016

2 references

language of work or name

CHEBI:65666 (English)

7 October 2016

matched by identifier from

PPZWAJHYVRKUKB-BPXWMNIUSA-N

mapping relation type

2 references

language of work or name

crambescidin 800 (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C45H80N6O6/c1-3-38-22-16-17-27-44(57-38)33-36-24-25-39-41(45(28-19-21-35(2)56-45)49-43(48-44)51(36)39)42(54)55-32-18-14-12-10-8-6-4-5-7-9-11-13-15-23-40(53)50(31-20-29-46)34-37(52)26-30-47/h16,22,35-39,41,52H,3-15,17-21,23-34,46-47H2,1-2H3,(H,48,49)/t35-,36+,37+,38+,39-,41-,44+,45-/m1/s1

1 reference

language of work or name

CHEMBL1739037 (English)

7 October 2016

UniChem compound ID

1 reference

MeSH descriptor ID

subject named as

crambescidin 800

0 references

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

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