(Q105025586)

English

(2S,3R,4S)-3-[2-(diaminomethylideneamino)ethyl]-4-[3-(diaminomethylideneamino)propyl]-2,4-dihydroxy-N,1-bis[(2S)-1-[[(E)-2-(4-hydroxyphenyl)ethenyl]amino]-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide

chemical compound

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instance of

type of chemical entity

0 references

subclass of

3-[2-(diaminomethylideneamino)ethyl]-4-[3-(diaminomethylideneamino)propyl]-2,4-dihydroxy-N,1-bis[1-[2-(4-hydroxyphenyl)ethenylamino]-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide

1 reference

based on heuristic

inferred from SMILES

mass

722.350008432 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

HCBLDZZFUFWBIT-PURYVXOCSA-N

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₄H₄₆N₁₀O₈

0 references

canonical SMILES

CC(NC(=O)C1(O)C(CCNC(=N)N)C(O)(CCCNC(=N)N)C(=O)N1C(C)C(=O)NC=Cc1ccc(O)cc1)C(=O)NC=Cc1ccc(O)cc1

0 references

isomeric SMILES

C[C@H](NC(=O)[C@@]1(O)[C@H](CCNC(=N)N)[C@@](O)(CCCNC(=N)N)C(=O)N1[C@@H](C)C(=O)N/C=C/c1ccc(O)cc1)C(=O)N/C=C/c1ccc(O)cc1

0 references

found in taxon

Phorbas tenacior

2 references

stated in

A dimeric peptide alkaloid of a completely new type, Anchinopeptolide A, from the marine sponge Anchinoe tenacior

stated in

Four new dimeric peptide alkaloids, anchinopeptolides B-D, and cycloanchinopeptolide C, congeners of anchinopeptolide A, from the Mediterranean marine sponge Anchinoe tenacior

Identifiers

InChI

InChI=1S/C34H46N10O8/c1-20(27(47)39-17-12-22-4-8-24(45)9-5-22)43-29(49)34(52)26(14-19-42-32(37)38)33(51,15-3-16-41-31(35)36)30(50)44(34)21(2)28(48)40-18-13-23-6-10-25(46)11-7-23/h4-13,17-18,20-21,26,45-46,51-52H,3,14-16,19H2,1-2H3,(H,39,47)(H,40,48)(H,43,49)(H4,35,36,41)(H4,37,38,42)/b17-12+,18-13+/t20-,21-,26+,33-,34-/m0/s1

0 references

InChIKey

HCBLDZZFUFWBIT-NCVYMDLJSA-N

0 references

2 references

15 September 2022

matched by identifier from

InChIKey

HCBLDZZFUFWBIT-NCVYMDLJSA-N

1 reference

(Q105025586)

(2S,3R,4S)-3-[2-(diaminomethylideneamino)ethyl]-4-[3-(diaminomethylideneamino)propyl]-2,4-dihydroxy-N,1-bis[(2S)-1-[[(E)-2-(4-hydroxyphenyl)ethenyl]amino]-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide

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