(Q105229063)

English

(3R,6S,9R,12R,19S)-19-hexyl-6-methyl-9-(2-methylpropyl)-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

biogenic cyclopeptide

0 references

mass

595.394499036 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₀H₅₃N₅O₇

0 references

canonical SMILES

CCCCCCC1CC(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C(C)C)C(=O)O1

0 references

isomeric SMILES

CCCCCC[C@H]1CC(=O)NCC(=O)N[C@H](C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(C)C)C(=O)O1

0 references

found in taxon

Beauveria felina

4 references

stated in

New insecticidal cyclodepsipeptides from the fungus Isaria felina. I. Production, isolation and insecticidal properties of isariins B. C and D

stated in

New insecticidal cyclodepsipeptides from the fungus Isaria felina. I. Production, isolation and insecticidal properties of isariins B. C and D

stated in

New insecticidal cyclodepsipeptides from the fungus Isaria felina. II. Structure elucidation of Isariins B, C and D.

stated in

New insecticidal cyclodepsipeptides from the fungus Isaria felina. II. Structure elucidation of Isariins B, C and D.

Isaria

1 reference

stated in

Identification and characterization of a library of microheterogeneous cyclohexadepsipeptides from the fungus Isaria

Identifiers

InChI

InChI=1S/C30H53N5O7/c1-9-10-11-12-13-21-15-23(36)31-16-24(37)34-25(18(4)5)29(40)33-22(14-17(2)3)28(39)32-20(8)27(38)35-26(19(6)7)30(41)42-21/h17-22,25-26H,9-16H2,1-8H3,(H,31,36)(H,32,39)(H,33,40)(H,34,37)(H,35,38)/t20-,21-,22+,25+,26+/m0/s1

0 references

InChIKey

QWBKHPNGPXORRV-WQVMVKNYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

QWBKHPNGPXORRV-WQVMVKNYSA-N

ChEBI ID

223411

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C30H53N5O7/c1-9-10-11-12-13-21-15-23(36)31-16-24(37)34-25(18(4)5)29(40)33-22(14-17(2)3)28(39)32-20(8)27(38)35-26(19(6)7)30(41)42-21/h17-22,25-26H,9-16H2,1-8H3,(H,31,36)(H,32,39)(H,33,40)(H,34,37)(H,35,38)/t20-,21-,22+,25+,26+/m0/s1

1 reference

Natural Product Atlas ID

NPA021019

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

QWBKHPNGPXORRV-WQVMVKNYSA-N

(Q105229063)

(3R,6S,9R,12R,19S)-19-hexyl-6-methyl-9-(2-methylpropyl)-3,12-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone

Statements

Identifiers

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