Janthitrem B

CAS Registry Number®

73561-90-7
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CAS Name

Janthitrem B

Molecular Formula

C37H47NO5

Molecular Mass

585.77

Cite this Page

Janthitrem B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=73561-90-7 (retrieved 2024-09-21) (CAS RN: 73561-90-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H47NO5/c1-18(2)31-27(39)16-25-28(42-31)10-11-35(7)36(8)19(9-12-37(25,35)41)13-23-21-14-22-20(15-26(21)38-32(23)36)24-17-33(3,4)43-34(5,6)29(24)30(22)40/h14-17,19,27-31,38-41H,1,9-13H2,2-8H3/t19-,27+,28-,29+,30+,31+,35+,36+,37+/m0/s1

InChIKey

InChIKey=FYYNBFCZCKFSKS-QSDHUPEDSA-N

SMILES

C[C@@]12[C@]3(C)[C@](O)(C=4[C@](CC3)(O[C@H](C(C)=C)[C@H](O)C4)[H])CC[C@]1(CC5=C2NC=6C5=CC7=C(C6)C=8[C@]([C@@H]7O)(C(C)(C)OC(C)(C)C8)[H])[H]

Canonical SMILES

OC1C=C2C(OC1C(=C)C)CCC3(C)C2(O)CCC4CC=5C6=CC7=C(C=C6NC5C43C)C8=CC(OC(C)(C)C8C7O)(C)C

Other Names for this Substance

  • 4bH-Pyrano[2′′,3′′:5′,6′]benz[1′,2′:6,7]indeno[1,2-b]pyrano[4′,3′:3,4]cyclopent[1,2-f]indole-3,4b,9-triol, 2,3,5,6,6a,7,9,9a,10,12,15,15b,15c,16,17,17a-hexadecahydro-10,10,12,12,15b,15c-hexamethyl-2-(1-methylethenyl)-, (2R,3R,4bS,6aS,9S,9aR,15bS,15cR,17aS)-
  • 4bH-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]pyrano[4′,3′:3,4]cyclopent[1,2-f]indole-3,4b,9-triol, 2,3,5,6,6a,7,9,9a,10,12,15,15b,15c,16,17,17a-hexadecahydro-10,10,12,12,15b,15c-hexamethyl-2-(1-methylethenyl)-, (2R,3R,4bS,6aS,9S,9aR,15bS,15cR,17aS)-
  • (2R,3R,4bS,6aS,9S,9aR,15bS,15cR,17aS)-2,3,5,6,6a,7,9,9a,10,12,15,15b,15c,16,17,17a-Hexadecahydro-10,10,12,12,15b,15c-hexamethyl-2-(1-methylethenyl)-4bH-pyrano[2′′,3′′:5′,6′]benz[1′,2′:6,7]indeno[1,2-b]pyrano[4′,3′:3,4]cyclopent[1,2-f]indole-3,4b,9-triol
  • Janthitrem B
  • Anhydrojanthitrem E