(Q75063488)

English

Pseudomycin-C'

bioactive natural product

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Statements

instance of

type of chemical entity

0 references

subclass of

KZSKIDBMTSZKLE-UHFFFAOYSA-N

1 reference

based on heuristic

inferred from SMILES

mass

1,234.621196372 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₃H₉₁ClN₁₂O₁₉

0 references

canonical SMILES

CC=C1NC(=O)C(C(C)O)NC(=O)C(CCN)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCN)NC(=O)C(NC(=O)CC(O)CCCCCCCCCCCCC)COC(=O)C(C(O)CCl)NC(=O)C(C(O)C(=O)O)NC1=O

0 references

isomeric SMILES

C/C=C1/NC(=O)C(C(C)O)NC(=O)C(CCN)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCN)NC(=O)C(NC(=O)CC(O)CCCCCCCCCCCCC)COC(=O)C(C(O)CCl)NC(=O)C(C(O)C(=O)O)NC1=O

1 reference

1 reference

Novel bioactive lipodepsipeptides from Pseudomonas syringae: the pseudomycins

Identifiers

InChI

InChI=1S/C53H91ClN12O19/c1-4-6-7-8-9-10-11-12-13-14-15-18-30(68)25-38(70)58-36-28-85-53(84)41(37(69)27-54)65-51(81)42(43(73)52(82)83)66-44(74)31(5-2)59-50(80)40(29(3)67)64-47(77)34(21-24-57)61-45(75)32(19-16-17-22-55)60-48(78)35(26-39(71)72)63-46(76)33(20-23-56)62-49(36)79/h5,29-30,32-37,40-43,67-69,73H,4,6-28,55-57H2,1-3H3,(H,58,70)(H,59,80)(H,60,78)(H,61,75)(H,62,79)(H,63,76)(H,64,77)(H,65,81)(H,66,74)(H,71,72)(H,82,83)/b31-5+

0 references

InChIKey

KZSKIDBMTSZKLE-RHZRYSSHSA-N

2 references

language of work or name

English

stated in

Natural Product Atlas

PubChem CID

139583522

language of work or name

1 reference

language of work or name

English

ChEBI ID

198871

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C53H91ClN12O19/c1-4-6-7-8-9-10-11-12-13-14-15-18-30(68)25-38(70)58-36-28-85-53(84)41(37(69)27-54)65-51(81)42(43(73)52(82)83)66-44(74)31(5-2)59-50(80)40(29(3)67)64-47(77)34(21-24-57)61-45(75)32(19-16-17-22-55)60-48(78)35(26-39(71)72)63-46(76)33(20-23-56)62-49(36)79/h5,29-30,32-37,40-43,67-69,73H,4,6-28,55-57H2,1-3H3,(H,58,70)(H,59,80)(H,60,78)(H,61,75)(H,62,79)(H,63,76)(H,64,77)(H,65,81)(H,66,74)(H,71,72)(H,82,83)/b31-5+

1 reference

Natural Product Atlas ID

NPA001529

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

KZSKIDBMTSZKLE-RHZRYSSHSA-N

(Q75063488)

Pseudomycin-C'

Statements

Identifiers

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