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Substance Name: Amycin B
RN: 129313-99-1
InChIKey: PPUSZMZQPGFMIJ-VYPJZZTKSA-N

Note

  • From Streptomyces sp DSM 3816.

Molecular Weight

  • 1056.4199
 
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Names and Synonyms

Name of Substance

  • Amycin B

Systematic Name

  • Scopafungin, 23-O-de(carboxyacetyl)-8,47-didemethyl-14,49-dimethyl-

Registry Numbers

CAS Registry Number

  • 129313-99-1

System Generated Number

  • 0129313991

Structure Descriptors

InChI

1S/C56H101N3O15/c1-33(18-14-12-10-11-13-17-25-59-55(57)58-9)26-37(5)52-36(4)19-15-16-20-44(62)38(6)48(66)29-42(61)27-41(60)28-43-30-50(68)53(70)56(72,74-43)32-51(69)35(3)22-23-45(63)39(7)49(67)31-47(65)34(2)21-24-46(64)40(8)54(71)73-52/h10-11,15-16,19-21,24,33-53,60-70,72H,12-14,17-18,22-23,25-32H2,1-9H3,(H3,57,58,59)/b11-10+,19-15-,20-16-,24-21-

InChIKey

PPUSZMZQPGFMIJ-VYPJZZTKSA-N

Smiles

CC1CCC(C(C(CC(C(/C=C\C(C(C(=O)OC(C(/C=C\C=C/C(C(C(CC(CC(CC2CC(C(C(O2)(CC1O)O)O)O)O)O)O)C)O)C)C(C)CC(C)CCC/C=C/CCCNC(=N)NC)C)O)C)O)O)C)O