(Q105226875)

English

QSDADIOCRLZWFK-RSLIBCCBSA-N

group of stereoisomers with the chemical formula C₅₂H₈₉ClN₁₂O₂₀

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Statements

group of stereoisomers

0 references

biogenic cyclopeptide

1 reference

biogenic cyclopeptide

1,236.600460928 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₂H₈₉ClN₁₂O₂₀

0 references

canonical SMILES

CC=C1NC(=O)C(C(C)O)NC(=O)C(CCN)NC(=O)C(CCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCN)NC(=O)C(NC(=O)CC(O)C(O)CCCCCCCCCCCC)COC(=O)C(C(O)CCl)NC(=O)C(C(O)C(=O)O)NC1=O

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isomeric SMILES

C/C=C1/NC(=O)C(C(C)O)NC(=O)C(CCN)NC(=O)C(CCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCN)NC(=O)C(NC(=O)CC(O)C(O)CCCCCCCCCCCC)COC(=O)C(C(O)CCl)NC(=O)C(C(O)C(=O)O)NC1=O

1 reference

based on heuristic

inferred from InChI

Pseudomonas syringae

2 references

Novel bioactive lipodepsipeptides from Pseudomonas syringae: the pseudomycins

Pseudomycins, a family of novel peptides from Pseudomonas syringae possessing broad-spectrum antifungal activity

Identifiers

InChI=1S/C52H89ClN12O20/c1-4-6-7-8-9-10-11-12-13-14-17-34(67)35(68)24-37(70)57-33-26-85-52(84)40(36(69)25-53)64-50(81)41(42(73)51(82)83)65-43(74)28(5-2)58-49(80)39(27(3)66)63-46(77)31(19-22-56)60-44(75)29(16-15-20-54)59-47(78)32(23-38(71)72)62-45(76)30(18-21-55)61-48(33)79/h5,27,29-36,39-42,66-69,73H,4,6-26,54-56H2,1-3H3,(H,57,70)(H,58,80)(H,59,78)(H,60,75)(H,61,79)(H,62,76)(H,63,77)(H,64,81)(H,65,74)(H,71,72)(H,82,83)/b28-5+

0 references

QSDADIOCRLZWFK-RSLIBCCBSA-N

0 references

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