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Substance Name: Janthitrem G
RN: 90986-51-9
InChIKey: PGYSJEQVCATFBQ-HNUHRZRSSA-N

Molecular Formula

  • C39-H51-N-O6

Molecular Weight

  • 629.833
 
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Names and Synonyms

Results Name

  • Janthitrem G

Synonym

  • Janthitrem G

Systematic Name

  • 4bH-1-Benzopyrano(5',6':6,7)indeno(1,2-b)pyrano(4',3':3,4)cyclopent(1,2-f)indole-3,4b-diol, 2,3,5,6,6a,7,9,9a,10,12,15,15b,15c,16,17,17a- hexadecahydro-2-(1-hydroxy-1-methylethyl)-10,10,12,12,15b,15c-hexamethyl-, 3-acetate, (2S,3R,4bS,6aS,9aS,15bS,15cR,17aS)-

Registry Numbers

CAS Registry Number

  • 90986-51-9

System Generated Number

  • 0090986519

Structure Descriptors

InChI

1S/C39H51NO6/c1-20(41)44-31-18-28-30(45-33(31)35(4,5)42)11-12-37(8)38(9)22(10-13-39(28,37)43)16-25-24-14-21-15-27-26(19-34(2,3)46-36(27,6)7)23(21)17-29(24)40-32(25)38/h14,17-19,22,27,30-31,33,40,42-43H,10-13,15-16H2,1-9H3/t22-,27-,30-,31+,33-,37+,38+,39+/m0/s1

InChIKey

PGYSJEQVCATFBQ-HNUHRZRSSA-N

Smiles

C1(OC(C)(C)C=C2[C@@H]1Cc1cc3c(cc21)[nH]c1c3C[C@H]2[C@@]1(C)[C@@]1([C@@](C=3[C@H](CC1)O[C@@H]([C@@H](C3)OC(C)=O)C(C)(C)O)(O)CC2)C)(C)C