Wicipedia

melittin

Creu erthygl

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pore-forming toxin in honey bees

Adnoddau allanol

Rhif Cofrestru CAS
20449-79-0[1]
Reaxys registry number
14626573[1]
PubChem CID
16133648[2][3]
60207992[3]
dynodwr MeSH
D008555

enwyd fel: Melitten

UniChem compound ID
139910[4]
dynodwr KEGG
C11198[1]
OpenAlex ID
C2778001312[5]
ChEMBL ID
CHEMBL412927[6]
InChIKey
VDXZNPDIRNWWCW-JFTDCZMZSA-N[2][7]
ChEBI ID
6736[1][8]

mapping relation type: exact match

DSSTox substance ID
DTXSID001046261[3]
Cod MeSH
D12.644.050.550
D12.644.066.500.550
D12.776.543.695.054.550
D20.888.065.115.580
D23.946.833.065.115.580
UMLS CUI
C0025234[9]
Transporter Classification Database ID
1.C.18.1.1[10][11]
ECHA Substance Infocard ID
100.157.496[12]
InChI
InChI=1S/C131H229N39O31/c1-23-71(16)102(163-97(176)60-135)122(194)146-62-98(177)148-74(19)109(181)164-100(69(12)13)124(196)160-88(55-65(4)5)116(188)155-84(41-30-33-51-134)115(187)165-101(70(14)15)125(197)161-90(57-67(8)9)118(190)168-106(77(22)173)128(200)169-105(76(21)172)123(195)147-63-99(178)150-92(58-68(10)11)129(201)170-54-36-44-94(170)121(193)149-75(20)108(180)158-89(56-66(6)7)117(189)166-104(73(18)25-3)127(199)162-93(64-171)120(192)159-91(59-78-61-145-80-38-27-26-37-79(78)80)119(191)167-103(72(17)24-2)126(198)157-83(40-29-32-50-133)111(183)154-85(42-34-52-143-130(139)140)112(184)152-82(39-28-31-49-132)110(182)153-86(43-35-53-144-131(141)142)113(185)156-87(46-48-96(137)175)114(186)151-81(107(138)179)45-47-95(136)174/h26-27,37-38,61,65-77,81-94,100-106,145,171-173H,23-25,28-36,39-60,62-64,132-135H2,1-22H3,(H2,136,174)(H2,137,175)(H2,138,179)(H,146,194)(H,147,195)(H,148,177)(H,149,193)(H,150,178)(H,151,186)(H,152,184)(H,153,182)(H,154,183)(H,155,188)(H,156,185)(H,157,198)(H,158,180)(H,159,192)(H,160,196)(H,161,197)(H,162,199)(H,163,176)(H,164,181)(H,165,187)(H,166,189)(H,167,191)(H,168,190)(H,169,200)(H4,139,140,143)(H4,141,142,144)/t71-,72-,73-,74-,75-,76+,77+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,100-,101-,102-,103-,104-,105-,106-/m0/s1
ChemSpider ID
17290230[13]
EC number
629-303-1[12]
dynodwr Freebase
/m/0491r9[14]
dynodwr Microsoft Academic
2778001312
WikiSkripta article ID
18774
UniProt protein ID
P01501
Probes And Drugs ID
PD017475
UNII
24VT8NVE75

enghraifft o'r canlynol

peptid
protein fragment

rhan o'r canlynol

apitoxin
Melittin family[15]

màs

2,845.757527 uned Dalton[2]

fformwla gemegol

C₁₃₁H₂₂₉N₃₉O₃₁[2]

SMILES

CCC(C)C(C(=O)NCC(=O)NC(C)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(=O)NC(C(C)O)C(=O)NCC(=O)NC(CC(C)C)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(=O)NC(CO)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC(C(C)CC)C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)N)NC(=O)CN[2]

isomeric SMILES

CC[C@H](C)[C@H](NC(=O)CN)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C

cynhwysyn actif yn

apitoxin

found in taxon

Apis mellifera[16]

categori Comin

Melittin

Cyfeiriadau

  1. ↑ 1.0 1.1 1.2 1.3 ChEBI, 5 Hydref 2016, Saesneg, melittin, 6736
  2. ↑ 2.0 2.1 2.2 2.3 2.4 PubChem, 5 Hydref 2016, Saesneg, 16133648, Melittin
  3. ↑ 3.0 3.1 3.2 VDXZNPDIRNWWCW-JFTDCZMZSA-N, InChIKey
  4. ↑ UniChem
  5. ↑ OpenAlex, 26 Ionawr 2022, https://docs.openalex.org/download-snapshot/snapshot-data-format
  6. ↑ ChEMBL, 5 Hydref 2016, Saesneg, MELITTIN, CHEMBL412927
  7. ↑ ChEBI release 2020-09-01
  8. ↑ International Chemical Identifier, InChI=1S/C131H229N39O31/c1-23-71(16)102(163-97(176)60-135)122(194)146-62-98(177)148-74(19)109(181)164-100(69(12)13)124(196)160-88(55-65(4)5)116(188)155-84(41-30-33-51-134)115(187)165-101(70(14)15)125(197)161-90(57-67(8)9)118(190)168-106(77(22)173)128(200)169-105(76(21)172)123(195)147-63-99(178)150-92(58-68(10)11)129(201)170-54-36-44-94(170)121(193)149-75(20)108(180)158-89(56-66(6)7)117(189)166-104(73(18)25-3)127(199)162-93(64-171)120(192)159-91(59-78-61-145-80-38-27-26-37-79(78)80)119(191)167-103(72(17)24-2)126(198)157-83(40-29-32-50-133)111(183)154-85(42-34-52-143-130(139)140)112(184)152-82(39-28-31-49-132)110(182)153-86(43-35-53-144-131(141)142)113(185)156-87(46-48-96(137)175)114(186)151-81(107(138)179)45-47-95(136)174/h26-27,37-38,61,65-77,81-94,100-106,145,171-173H,23-25,28-36,39-60,62-64,132-135H2,1-22H3,(H2,136,174)(H2,137,175)(H2,138,179)(H,146,194)(H,147,195)(H,148,177)(H,149,193)(H,150,178)(H,151,186)(H,152,184)(H,153,182)(H,154,183)(H,155,188)(H,156,185)(H,157,198)(H,158,180)(H,159,192)(H,160,196)(H,161,197)(H,162,199)(H,163,176)(H,164,181)(H,165,187)(H,166,189)(H,167,191)(H,168,190)(H,169,200)(H4,139,140,143)(H4,141,142,144)/t71-,72-,73-,74-,75-,76+,77+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,100-,101-,102-,103-,104-,105-,106-/m0/s1
  9. ↑ UMLS 2023, 24 Mai 2023, inferred by common MeSH mappings on source and on Wikidata
  10. ↑ Transporter Classification database, 13 Mawrth 2020
  11. ↑ Transporter Classification database, 29 Ebrill 2020
  12. ↑ 12.0 12.1 ECHA Substance Infocard database, 27 Rhagfyr 2018, 100.157.496, [No public or meaningful name is available], CAS no.: 20449-79-0
  13. ↑ ChemSpider, 5 Hydref 2016, Saesneg, 17290230, Melittin
  14. ↑ Freebase Data Dumps, 28 Hydref 2013
  15. ↑ 1.C.18, 2 Hydref 2019, hierarchical database ID heuristic
  16. ↑ Melittin synthesis in the venom system of the honey bee (Apis mellifera L.).
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