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Substance Name: Phalloidin, S-oxide, (S,S)-
RN: 51085-06-4
InChIKey: QLUGAIPGPFSEEB-NUDQSVDYSA-N

Molecular Formula

  • C35-H48-N8-O12-S

Molecular Weight

  • 804.8742
 
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Names and Synonyms

  • Phalloidin, S-oxide, (S,S)-

Registry Numbers

CAS Registry Number

  • 51085-06-4

System Generated Number

  • 0051085064

Structure Descriptors

InChI

1S/C35H48N8O12S/c1-15-27(47)38-22-10-20-19-7-5-6-8-21(19)41-33(20)56(55)13-24(34(53)43-12-18(46)9-25(43)31(51)37-15)40-32(52)26(17(3)45)42-28(48)16(2)36-30(50)23(39-29(22)49)11-35(4,54)14-44/h5-8,15-18,22-26,41,44-46,54H,9-14H2,1-4H3,(H,36,50)(H,37,51)(H,38,47)(H,39,49)(H,40,52)(H,42,48)/t15-,16-,17-,18+,22-,23-,24+,25-,26+,35+,56?/m0/s1

InChIKey

QLUGAIPGPFSEEB-NUDQSVDYSA-N

Smiles

C[C@H]1C(=O)N[C@H]2Cc3c4ccccc4[nH]c3S(=O)C[C@H](C(=O)N5C[C@@H](C[C@H]5C(=O)N1)O)NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)C[C@](C)(CO)O)C)[C@H](C)O