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Substance Name: Cyclosporin B
RN: 63775-95-1
UNII: 8PZQ1RZS5A
InChIKey: UCOQITKXMNKTKF-MXGZYYNMSA-N

Molecular Formula

  • C61-H109-N11-O12

Molecular Weight

  • 1188.5971
 
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Names and Synonyms

Name of Substance

  • Cyclosporin B

Synonym

  • UNII-8PZQ1RZS5A

Systematic Name

  • Cyclosporin A, 7-L-alanine-

Registry Numbers

CAS Registry Number

  • 63775-95-1

FDA UNII

  • 8PZQ1RZS5A

System Generated Number

  • 0063775951

Structure Descriptors

InChI

1S/C61H109N11O12/c1-25-26-27-39(14)51(74)50-55(78)64-41(16)56(79)66(18)32-47(73)67(19)43(28-33(2)3)54(77)65-48(37(10)11)60(83)68(20)44(29-34(4)5)53(76)62-40(15)52(75)63-42(17)57(80)69(21)45(30-35(6)7)58(81)70(22)46(31-36(8)9)59(82)71(23)49(38(12)13)61(84)72(50)24/h25-26,33-46,48-51,74H,27-32H2,1-24H3,(H,62,76)(H,63,75)(H,64,78)(H,65,77)/b26-25+/t39-,40+,41+,42-,43+,44+,45+,46+,48+,49+,50+,51-/m1/s1

InChIKey

UCOQITKXMNKTKF-MXGZYYNMSA-N

Smiles

C\C=C\C[C@@H](C)[C@@H](O)[C@@H]1N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H](C)NC1=O)C(C)C