Janthitrem F
CAS Registry Number®
90986-52-0
CAS Name
Janthitrem FMolecular Formula
C39H51NO7Molecular Mass
645.82Cite this Page
Janthitrem F. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=90986-52-0 (retrieved ) (CAS RN: 90986-52-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C39H51NO7/c1-19(41)45-29-17-26-28(46-33(29)35(4,5)43)11-12-37(8)38(9)20(10-13-39(26,37)44)14-24-22-15-23-21(16-27(22)40-32(24)38)25-18-34(2,3)47-36(6,7)30(25)31(23)42/h15-18,20,28-31,33,40,42-44H,10-14H2,1-9H3/t20-,28-,29+,30+,31+,33-,37+,38+,39+/m0/s1
InChIKey
InChIKey=SHMYDSYGDWIPKT-WWVOELFWSA-N
SMILES
C[C@@]12[C@]3(C)[C@](O)(C=4[C@](CC3)(O[C@H]([C@](C)(C)O)[C@H](OC(C)=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
O=C(OC1C=C2C(OC1C(O)(C)C)CCC3(C)C2(O)CCC4CC=5C6=CC7=C(C=C6NC5C43C)C8=CC(OC(C)(C)C8C7O)(C)C)C
Other Names for this Substance
- 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-2-(1-hydroxy-1-methylethyl)-10,10,12,12,15b,15c-hexamethyl-, 3-acetate, (2S,3R,4bS,6aS,9S,9aR,15bS,15cR,17aS)-
- Janthitrem F
- Janthitrem E monoacetate (ester)