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Substance Name: Azalomycin F5a
RN: 85113-99-1
UNII: H7Q3DUM9N6
InChIKey: SPNDCJQGKUZBHK-HQKIQJKYSA-N

Note

  • Isolated from mangrove rhizosphere soil.

Molecular Formula

  • C57-H97-N3-O17

Molecular Weight

  • 1096.3973
 
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Names and Synonyms

Name of Substance

  • Azalomycin F5a

Synonyms

  • Azalomycin F5
  • Azalomycin F5a
  • UNII-H7Q3DUM9N6

Registry Numbers

CAS Registry Number

  • 85113-99-1

FDA UNII

  • H7Q3DUM9N6

System Generated Number

  • 0085113991

Structure Descriptors

InChI

1S/C57H97N3O17/c1-34-19-16-21-38(5)53(37(4)18-14-12-10-11-13-15-25-60-56(58-8)59-9)76-55(73)39(6)22-17-20-35(2)47(65)31-48(66)40(7)45(63)24-23-36(3)50(68)33-57(74)54(72)49(67)30-44(77-57)29-43(75-52(71)32-51(69)70)27-41(61)26-42(62)28-46(34)64/h10-11,16-17,19-22,35-38,40-50,53-54,61-68,72,74H,12-15,18,23-33H2,1-9H3,(H,69,70)(H2,58,59,60)/b11-10+,20-17+,21-16+,34-19+,39-22+/t35-,36-,37-,38+,40-,41+,42+,43-,44-,45+,46-,47-,48-,49+,50-,53-,54-,57+/m0/s1

InChIKey

SPNDCJQGKUZBHK-HQKIQJKYSA-N

Smiles

C[C@H]1CC[C@H]([C@@H]([C@H](C[C@@H]([C@H](/C=C/C=C(/C(=O)O[C@H]([C@@H](/C=C/C=C(/[C@H](C[C@@H](C[C@H](C[C@@H](C[C@H]2C[C@H]([C@@H]([C@](O2)(C[C@@H]1O)O)O)O)OC(=O)CC(=O)O)O)O)O)\C)C)[C@@H](C)CCC/C=C/CCCN=C(NC)NC)\C)C)O)O)C)O