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Substance Name: FR-008V
RN: 850873-25-5
UNII: HMJ2B54T12
InChIKey: AHQVLCZJUYBHQK-FXHHNODTSA-N

Molecular Formula

  • C59-H86-N2-O17.C-H4

Molecular Weight

  • 1111.368
 
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Names and Synonyms

Name of Substance

  • FR-008V

Synonyms

  • Candicidin D, 3-deoxo-3-hydroxy-, cyclic 15,19-hemiacetal
  • FR-008V
  • UNII-HMJ2B54T12

Registry Numbers

CAS Registry Number

  • 850873-25-5

FDA UNII

  • HMJ2B54T12

System Generated Number

  • 0850873255

Structure Descriptors

InChI

1S/C59H86N2O17.CH4/c1-35-18-15-13-11-9-7-5-6-8-10-12-14-16-21-46(77-59-56(72)54(61)55(71)38(4)75-59)33-51-53(58(73)74)50(69)32-47(76-51)30-45(66)29-44(65)28-43(64)27-41(62)19-17-20-42(63)31-52(70)78-57(35)37(3)26-36(2)48(67)34-49(68)39-22-24-40(60)25-23-39;/h5-16,18,21-25,35-38,42-48,50-51,53-57,59,63-67,69,71-72H,17,19-20,26-34,60-61H2,1-4H3,(H,73,74);1H4/b6-5+,9-7+,10-8+,13-11+,14-12+,18-15+,21-16+;/t35-,36-,37-,38+,42?,43-,44-,45-,46-,47?,48-,50-,51-,53+,54-,55+,56-,57-,59-;/m0./s1

InChIKey

AHQVLCZJUYBHQK-FXHHNODTSA-N

Smiles

C.C[C@H]1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/[C@@H](C[C@H]2[C@@H]([C@H](CC(O2)C[C@H](C[C@H](C[C@H](CC(=O)CCCC(CC(=O)O[C@@H]1[C@@H](C)C[C@H](C)[C@H](CC(=O)c3ccc(cc3)N)O)O)O)O)O)O)C(=O)O)O[C@H]4[C@H]([C@H]([C@@H]([C@H](O4)C)O)N)O